4-chloranyl-N-cyclopropyl-N-[2-[2-(1H-indol-3-yl)ethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-cyclopropyl-N-[2-[2-(1H-indol-3-yl)ethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[benzyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxo-ethyl]-4-chloro-N-cyclopropyl-3-nitro-benzamide CAS Name: 4-chloro-N-cyclopropyl-N-[2-[2-(1H-indol-3-yl)ethyl-(phenylmethyl)amino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[benzyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]-4-chloro-N-cyclopropyl-3-nitrobenzamide Traditional Name: N-[2-[benzyl-[2-(1H-indol-3-yl)ethyl]amino]-2-keto-ethyl]-4-chloro-N-cyclopropyl-3-nitro-benzamide Formula: C29H27ClN4O4 MolecularWeight: 531.00208

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC(=O)N(CCC2=CNC3=CC=CC=C32)CC4=CC=CC=C4)C(=O)C5=CC(=C(C=C5)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CC1N(CC(=O)N(CCC2=CNC3=CC=CC=C32)CC4=CC=CC=C4)C(=O)C5=CC(=C(C=C5)Cl)[N+](=O)[O-]

InChI

InChI=1S/C29H27ClN4O4/c30-25-13-10-21(16-27(25)34(37)38)29(36)33(23-11-12-23)19-28(35)32(18-20-6-2-1-3-7-20)15-14-22-17-31-26-9-5-4-8-24(22)26/h1-10,13,16-17,23,31H,11-12,14-15,18-19H2