SSR126768

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Systematic / IUPAC Name: 4-Chloro-3-[(3R)-5-chloro-1-(2,4-dimethoxybenzyl)-3-methyl-2-oxo-2,3-dihydro-1H-indol-3-yl]-N-ethyl-N-(3-pyridinylmethyl)benzamide

ID: Reference2876

Other Names: Benzamide, 4-chloro-3-[(3R)-5-chloro-1-[(2,4-dimethoxyphenyl)methyl]-2,3-dihydro-3-methyl-2-oxo-1H-indol-3-yl]-N-ethyl-N-(3-pyridinylmethyl)-

Formula: C33H31Cl2N3O4

Spectral Data

SSR126768 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 Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 6/26/2015 10:16:59 AM
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Identificators

InChI InChI=1S/C33H31Cl2N3O4/c1-5-37(19-21-7-6-14-36-18-21)31(39)22-9-12-28(35)26(15-22)33(2)27-16-24(34)10-13-29(27)38(32(33)40)20-23-8-11-25(41-3)17-30(23)42-4/h6-18H,5,19-20H2,1-4H3/t33-/m0/s1
InChI Key UENRBNCNIZQNTR-XIFFEERXSA-N
Canonical SMILES CCN(CC1=CN=CC=C1)C(=O)C2=CC(=C(C=C2)Cl)C3(C4=C(C=CC(=C4)Cl)N(C3=O)CC5=C(C=C(C=C5)OC)OC)C
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Other Names Benzamide, 4-chloro-3-[(3R)-5-chloro-1-[(2,4-dimethoxyphenyl)methyl]-2,3-dihydro-3-methyl-2-oxo-1H-indol-3-yl]-N-ethyl-N-(3-pyridinylmethyl)-

In Other Databases

ChEMBL CHEMBL1615640
PubChem 10461270
ChemSpider 8636683