3-[5-nitro-1-(phenylmethyl)indol-3-yl]-3-phenyl-N-(2-piperidin-1-ylethyl)propanamide

Systemtic Name: 3-[5-nitro-1-(phenylmethyl)indol-3-yl]-3-phenyl-N-(2-piperidin-1-ylethyl)propanamide Openeye Name: 3-(1-benzyl-5-nitro-indol-3-yl)-3-phenyl-N-[2-(1-piperidyl)ethyl]propanamide CAS Name: 3-[5-nitro-1-(phenylmethyl)-3-indolyl]-3-phenyl-N-[2-(1-piperidinyl)ethyl]propanamide IUPAC Name: 3-(1-benzyl-5-nitroindol-3-yl)-3-phenyl-N-(2-piperidin-1-ylethyl)propanamide Traditional Name: 3-(1-benzyl-5-nitro-indol-3-yl)-3-phenyl-N-(2-piperidinoethyl)propionamide Formula: C31H34N4O3 MolecularWeight: 510.62666

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNC(=O)CC(C2=CC=CC=C2)C3=CN(C4=C3C=C(C=C4)[N+](=O)[O-])CC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)CCNC(=O)CC(C2=CC=CC=C2)C3=CN(C4=C3C=C(C=C4)[N+](=O)[O-])CC5=CC=CC=C5

InChI

InChI=1S/C31H34N4O3/c36-31(32-16-19-33-17-8-3-9-18-33)21-27(25-12-6-2-7-13-25)29-23-34(22-24-10-4-1-5-11-24)30-15-14-26(35(37)38)20-28(29)30/h1-2,4-7,10-15,20,23,27H,3,8-9,16-19,21-22H2,(H,32,36)