methyl 1-[2-[1-[(4-methoxy-2-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]oxy-2-oxidanylidene-ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-[1-[(4-methoxy-2-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]oxy-2-oxidanylidene-ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-[2-(4-methoxy-2-nitro-anilino)-1-methyl-2-oxo-ethoxy]-2-oxo-ethyl]indole-3-carboxylate CAS Name: 1-[2-[1-(4-methoxy-2-nitroanilino)-1-oxopropan-2-yl]oxy-2-oxoethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[1-(4-methoxy-2-nitroanilino)-1-oxopropan-2-yl]oxy-2-oxoethyl]indole-3-carboxylate Traditional Name: 1-[2-keto-2-[2-keto-2-(4-methoxy-2-nitro-anilino)-1-methyl-ethoxy]ethyl]indole-3-carboxylic acid methyl ester Formula: C22H21N3O8 MolecularWeight: 455.41744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-])OC(=O)CN2C=C(C3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-])OC(=O)CN2C=C(C3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C22H21N3O8/c1-13(21(27)23-17-9-8-14(31-2)10-19(17)25(29)30)33-20(26)12-24-11-16(22(28)32-3)15-6-4-5-7-18(15)24/h4-11,13H,12H2,1-3H3,(H,23,27)