6,7-dimethoxy-2-methyl-4-[2-(3-nitrophenyl)ethanoyl-(phenylmethyl)amino]-3,4-dihydro-2H-quinoline-1-carboxylic acid

Systemtic Name: 6,7-dimethoxy-2-methyl-4-[2-(3-nitrophenyl)ethanoyl-(phenylmethyl)amino]-3,4-dihydro-2H-quinoline-1-carboxylic acid Openeye Name: 4-[benzyl-[2-(3-nitrophenyl)acetyl]amino]-6,7-dimethoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid CAS Name: 6,7-dimethoxy-2-methyl-4-[[2-(3-nitrophenyl)-1-oxoethyl]-(phenylmethyl)amino]-3,4-dihydro-2H-quinoline-1-carboxylic acid IUPAC Name: 4-[benzyl-[2-(3-nitrophenyl)acetyl]amino]-6,7-dimethoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid Traditional Name: 4-[benzyl-[2-(3-nitrophenyl)acetyl]amino]-6,7-dimethoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid Formula: C28H29N3O7 MolecularWeight: 519.54576

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C2=CC(=C(C=C2N1C(=O)O)OC)OC)N(CC3=CC=CC=C3)C(=O)CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1CC(C2=CC(=C(C=C2N1C(=O)O)OC)OC)N(CC3=CC=CC=C3)C(=O)CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C28H29N3O7/c1-18-12-23(22-15-25(37-2)26(38-3)16-24(22)30(18)28(33)34)29(17-19-8-5-4-6-9-19)27(32)14-20-10-7-11-21(13-20)31(35)36/h4-11,13,15-16,18,23H,12,14,17H2,1-3H3,(H,33,34)