4-(4-fluorophenyl)-2,6,7-trimethyl-1-oxidanylidene-isoquinoline-3-carboxylic acid

Systemtic Name: 4-(4-fluorophenyl)-2,6,7-trimethyl-1-oxidanylidene-isoquinoline-3-carboxylic acid Openeye Name: 4-(4-fluorophenyl)-2,6,7-trimethyl-1-oxo-isoquinoline-3-carboxylic acid CAS Name: 4-(4-fluorophenyl)-2,6,7-trimethyl-1-oxo-3-isoquinolinecarboxylic acid IUPAC Name: 4-(4-fluorophenyl)-2,6,7-trimethyl-1-oxoisoquinoline-3-carboxylic acid Traditional Name: 4-(4-fluorophenyl)-1-keto-2,6,7-trimethyl-isoquinoline-3-carboxylic acid Formula: C19H16FNO3 MolecularWeight: 325.333643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)C(=O)O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)C(=O)O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C19H16FNO3/c1-10-8-14-15(9-11(10)2)18(22)21(3)17(19(23)24)16(14)12-4-6-13(20)7-5-12/h4-9H,1-3H3,(H,23,24)