1-(3-ethoxycarbonyl-5-nitro-phenyl)carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid

Systemtic Name: 1-(3-ethoxycarbonyl-5-nitro-phenyl)carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-(3-ethoxycarbonyl-5-nitro-benzoyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[(3-ethoxycarbonyl-5-nitrophenyl)-oxomethyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-(3-ethoxycarbonyl-5-nitrobenzoyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-(3-carbethoxy-5-nitro-benzoyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C20H18N2O7 MolecularWeight: 398.36612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCCC3=C(C=CC=C32)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCCC3=C(C=CC=C32)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C20H18N2O7/c1-2-29-20(26)13-9-12(10-14(11-13)22(27)28)18(23)21-8-4-6-15-16(19(24)25)5-3-7-17(15)21/h3,5,7,9-11H,2,4,6,8H2,1H3,(H,24,25)