N-{(4R,7S,8aS)-4-[3-(2,3-Dihydro-1H-indol-1-yl)-3-oxopropyl]-1-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}-4-(dimethylamino)benzamide

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Systematic / IUPAC Name: N-[(4R,7S,8aS)-4-[3-(2,3-Dihydroindol-1-yl)-3-oxopropyl]-1-oxo-3,4,6,7,8,8a-hexahydro-2H-pyrrolo[1,2-a]pyrazin-7-yl]-4-(dimethylamino)benzamide

ID: Reference9384

Other Names: Benzamide, N-[(4R,7S,8aS)-4-[3-(2,3-dihydro-1H-indol-1-yl)-3-oxopropyl]octahydro-1-oxopyrrolo[1,2-a]pyrazin-7-yl]-4-(dimethylamino)-;
NAT23-379290

Formula: C27H33N5O3

Spectral Data

N-{(4R,7S,8aS)-4-[3-(2,3-Dihydro-1H-indol-1-yl)-3-oxopropyl]-1-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}-4-(dimethylamino)benzamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 2600
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6, MS7
Ionization Methods NSI
Analyzers FT
Last Modification 2/17/2020 8:40:03 AM
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Identificators

InChI InChI=1S/C27H33N5O3/c1-30(2)21-9-7-19(8-10-21)26(34)29-20-15-24-27(35)28-16-22(32(24)17-20)11-12-25(33)31-14-13-18-5-3-4-6-23(18)31/h3-10,20,22,24H,11-17H2,1-2H3,(H,28,35)(H,29,34)/t20-,22+,24-/m0/s1
InChI Key VOIRRFXEZGYRDC-FJIJXJHWSA-N
Canonical SMILES CN(C)C1=CC=C(C=C1)C(=O)NC2CC3C(=O)NCC(N3C2)CCC(=O)N4CCC5=CC=CC=C54
CAS
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Other Names Benzamide, N-[(4R,7S,8aS)-4-[3-(2,3-dihydro-1H-indol-1-yl)-3-oxopropyl]octahydro-1-oxopyrrolo[1,2-a]pyrazin-7-yl]-4-(dimethylamino)-;
NAT23-379290

In Other Databases

PubChem 26762194
ChemSpider 21382462