4-oxidanylidene-1-pentyl-2-phenyl-quinoline-3-carboxylic acid

Systemtic Name: 4-oxidanylidene-1-pentyl-2-phenyl-quinoline-3-carboxylic acid Openeye Name: 4-oxo-1-pentyl-2-phenyl-quinoline-3-carboxylic acid CAS Name: 4-oxo-1-pentyl-2-phenyl-3-quinolinecarboxylic acid IUPAC Name: 4-oxo-1-pentyl-2-phenylquinoline-3-carboxylic acid Traditional Name: 1-amyl-4-keto-2-phenyl-quinoline-3-carboxylic acid Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2C(=O)C(=C1C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCCCN1C2=CC=CC=C2C(=O)C(=C1C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H21NO3/c1-2-3-9-14-22-17-13-8-7-12-16(17)20(23)18(21(24)25)19(22)15-10-5-4-6-11-15/h4-8,10-13H,2-3,9,14H2,1H3,(H,24,25)