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

Systemtic Name: 6,7-dimethoxy-2-methyl-4-[2-(4-nitrophenyl)ethanoyl-(phenylmethyl)amino]-3,4-dihydro-2H-quinoline-1-carboxylic acid Openeye Name: 4-[benzyl-[2-(4-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-(4-nitrophenyl)-1-oxoethyl]-(phenylmethyl)amino]-3,4-dihydro-2H-quinoline-1-carboxylic acid IUPAC Name: 4-[benzyl-[2-(4-nitrophenyl)acetyl]amino]-6,7-dimethoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid Traditional Name: 4-[benzyl-[2-(4-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=C(C=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=C(C=C4)[N+](=O)[O-]

InChI

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