ethyl 2-[(4-azanyl-3-nitro-phenyl)carbonyloxymethyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: ethyl 2-[(4-azanyl-3-nitro-phenyl)carbonyloxymethyl]-4-methyl-quinoline-3-carboxylate Openeye Name: ethyl 2-[(4-amino-3-nitro-benzoyl)oxymethyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[(4-amino-3-nitrophenyl)-oxomethoxy]methyl]-4-methyl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-amino-3-nitrobenzoyl)oxymethyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[(4-amino-3-nitro-benzoyl)oxymethyl]-4-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C21H19N3O6 MolecularWeight: 409.39206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-])C

InChI

InChI=1S/C21H19N3O6/c1-3-29-21(26)19-12(2)14-6-4-5-7-16(14)23-17(19)11-30-20(25)13-8-9-15(22)18(10-13)24(27)28/h4-10H,3,11,22H2,1-2H3