methyl 1-[2-(2-methyl-5-nitro-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-(2-methyl-5-nitro-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-(2-methyl-5-nitro-indolin-1-yl)-2-oxo-ethyl]indole-3-carboxylate CAS Name: 1-[2-(2-methyl-5-nitro-2,3-dihydroindol-1-yl)-2-oxoethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(2-methyl-5-nitro-2,3-dihydroindol-1-yl)-2-oxoethyl]indole-3-carboxylate Traditional Name: 1-[2-keto-2-(2-methyl-5-nitro-indolin-1-yl)ethyl]indole-3-carboxylic acid methyl ester Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1C(=O)CN3C=C(C4=CC=CC=C43)C(=O)OC)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC1CC2=C(N1C(=O)CN3C=C(C4=CC=CC=C43)C(=O)OC)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O5/c1-13-9-14-10-15(24(27)28)7-8-18(14)23(13)20(25)12-22-11-17(21(26)29-2)16-5-3-4-6-19(16)22/h3-8,10-11,13H,9,12H2,1-2H3