methyl 4-methyl-2-[(4-nitrophenyl)carbonyloxymethyl]quinoline-3-carboxylate

Systemtic Name: methyl 4-methyl-2-[(4-nitrophenyl)carbonyloxymethyl]quinoline-3-carboxylate Openeye Name: methyl 4-methyl-2-[(4-nitrobenzoyl)oxymethyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[(4-nitrophenyl)-oxomethoxy]methyl]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[(4-nitrobenzoyl)oxymethyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[(4-nitrobenzoyl)oxymethyl]quinoline-3-carboxylic acid methyl ester Formula: C20H16N2O6 MolecularWeight: 380.35084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16N2O6/c1-12-15-5-3-4-6-16(15)21-17(18(12)20(24)27-2)11-28-19(23)13-7-9-14(10-8-13)22(25)26/h3-10H,11H2,1-2H3