3-[[7,8-bis(chloranyl)-3-ethoxycarbonyl-quinolin-4-yl]amino]benzoic acid

Systemtic Name: 3-[[7,8-bis(chloranyl)-3-ethoxycarbonyl-quinolin-4-yl]amino]benzoic acid Openeye Name: 3-[(7,8-dichloro-3-ethoxycarbonyl-4-quinolyl)amino]benzoic acid CAS Name: 3-[(7,8-dichloro-3-ethoxycarbonyl-4-quinolinyl)amino]benzoic acid IUPAC Name: 3-[(7,8-dichloro-3-ethoxycarbonylquinolin-4-yl)amino]benzoic acid Traditional Name: 3-[(3-carbethoxy-7,8-dichloro-4-quinolyl)amino]benzoic acid Formula: C19H14Cl2N2O4 MolecularWeight: 405.23146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1NC3=CC=CC(=C3)C(=O)O)C=CC(=C2Cl)Cl

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1NC3=CC=CC(=C3)C(=O)O)C=CC(=C2Cl)Cl

InChI

InChI=1S/C19H14Cl2N2O4/c1-2-27-19(26)13-9-22-17-12(6-7-14(20)15(17)21)16(13)23-11-5-3-4-10(8-11)18(24)25/h3-9H,2H2,1H3,(H,22,23)(H,24,25)