N-{(1R,9S)-11-[(1-Methyl-1H-indol-3-yl)methyl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl}benzamide

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Systematic / IUPAC Name: N-[(1R,9S)-11-[(1-Methylindol-3-yl)methyl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]benzamide

ID: Reference9933

Other Names: Benzamide, N-[(1R,5S)-1,3,4,5,6,8-hexahydro-3-[(1-methyl-1H-indol-3-yl)methyl]-8-oxo-1,5-methano-2H-pyrido[1,2-a][1,5]diazocin-9-yl]-;
NAT11-303437

Formula: C28H28N4O2

Spectral Data

N-{(1R,9S)-11-[(1-Methyl-1H-indol-3-yl)methyl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl}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 2311
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6, MS7
Ionization Methods NSI
Analyzers FT
Last Modification 9/10/2020 8:41:43 AM
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Identificators

InChI InChI=1S/C28H28N4O2/c1-30-16-22(23-9-5-6-10-26(23)30)18-31-14-19-13-21(17-31)25-12-11-24(28(34)32(25)15-19)29-27(33)20-7-3-2-4-8-20/h2-12,16,19,21H,13-15,17-18H2,1H3,(H,29,33)/t19-,21+/m0/s1
InChI Key KUDYKEZDIMCQGB-PZJWPPBQSA-N
Canonical SMILES CN1C=C(C2=CC=CC=C21)CN3CC4CC(C3)C5=CC=C(C(=O)N5C4)NC(=O)C6=CC=CC=C6
CAS
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Other Names Benzamide, N-[(1R,5S)-1,3,4,5,6,8-hexahydro-3-[(1-methyl-1H-indol-3-yl)methyl]-8-oxo-1,5-methano-2H-pyrido[1,2-a][1,5]diazocin-9-yl]-;
NAT11-303437

In Other Databases

PubChem 7051670
ChemSpider 5409875