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

Systemtic Name: N-(2-methoxyethyl)-3-[5-nitro-1-(phenylmethyl)indol-3-yl]-3-phenyl-propanamide Openeye Name: 3-(1-benzyl-5-nitro-indol-3-yl)-N-(2-methoxyethyl)-3-phenyl-propanamide CAS Name: N-(2-methoxyethyl)-3-[5-nitro-1-(phenylmethyl)-3-indolyl]-3-phenylpropanamide IUPAC Name: 3-(1-benzyl-5-nitroindol-3-yl)-N-(2-methoxyethyl)-3-phenylpropanamide Traditional Name: 3-(1-benzyl-5-nitro-indol-3-yl)-N-(2-methoxyethyl)-3-phenyl-propionamide Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)CC(C1=CC=CC=C1)C2=CN(C3=C2C=C(C=C3)[N+](=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

COCCNC(=O)CC(C1=CC=CC=C1)C2=CN(C3=C2C=C(C=C3)[N+](=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O4/c1-34-15-14-28-27(31)17-23(21-10-6-3-7-11-21)25-19-29(18-20-8-4-2-5-9-20)26-13-12-22(30(32)33)16-24(25)26/h2-13,16,19,23H,14-15,17-18H2,1H3,(H,28,31)