2-(4-carboxyphenyl)-6-methyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(4-carboxyphenyl)-6-methyl-quinoline-4-carboxylic acid Openeye Name: 2-(4-carboxyphenyl)-6-methyl-quinoline-4-carboxylic acid CAS Name: 2-(4-carboxyphenyl)-6-methyl-4-quinolinecarboxylic acid IUPAC Name: 2-(4-carboxyphenyl)-6-methylquinoline-4-carboxylic acid Traditional Name: 2-(4-carboxyphenyl)-6-methyl-cinchoninic acid Formula: C18H13NO4 MolecularWeight: 307.30012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H13NO4/c1-10-2-7-15-13(8-10)14(18(22)23)9-16(19-15)11-3-5-12(6-4-11)17(20)21/h2-9H,1H3,(H,20,21)(H,22,23)