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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)C3=CC(=C(C=C3)NC)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)C3=CC(=C(C=C3)NC)[N+](=O)[O-])C(=O)OC

InChI

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