(phenylmethyl) N-[3-(1H-indol-3-yl)-1-[(2-methyl-5-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[3-(1H-indol-3-yl)-1-[(2-methyl-5-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: benzyl N-[1-(1H-indol-3-ylmethyl)-2-(2-methyl-5-nitro-anilino)-2-oxo-ethyl]carbamate CAS Name: N-[3-(1H-indol-3-yl)-1-(2-methyl-5-nitroanilino)-1-oxopropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-(1H-indol-3-yl)-1-(2-methyl-5-nitroanilino)-1-oxopropan-2-yl]carbamate Traditional Name: N-[1-(1H-indol-3-ylmethyl)-2-keto-2-(2-methyl-5-nitro-anilino)ethyl]carbamic acid benzyl ester Formula: C26H24N4O5 MolecularWeight: 472.49256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H24N4O5/c1-17-11-12-20(30(33)34)14-23(17)28-25(31)24(13-19-15-27-22-10-6-5-9-21(19)22)29-26(32)35-16-18-7-3-2-4-8-18/h2-12,14-15,24,27H,13,16H2,1H3,(H,28,31)(H,29,32)