1-[(3-methylphenyl)methyl]-2-oxidanylidene-quinoline-4-carboxylic acid

Systemtic Name: 1-[(3-methylphenyl)methyl]-2-oxidanylidene-quinoline-4-carboxylic acid Openeye Name: 1-(m-tolylmethyl)-2-oxo-quinoline-4-carboxylic acid CAS Name: 1-[(3-methylphenyl)methyl]-2-oxo-4-quinolinecarboxylic acid IUPAC Name: 1-[(3-methylphenyl)methyl]-2-oxoquinoline-4-carboxylic acid Traditional Name: 2-keto-1-(3-methylbenzyl)cinchoninic acid Formula: C18H15NO3 MolecularWeight: 293.3166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C3=CC=CC=C3C(=CC2=O)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)CN2C3=CC=CC=C3C(=CC2=O)C(=O)O

InChI

InChI=1S/C18H15NO3/c1-12-5-4-6-13(9-12)11-19-16-8-3-2-7-14(16)15(18(21)22)10-17(19)20/h2-10H,11H2,1H3,(H,21,22)