3-(4-fluorophenyl)-3-methyl-4-oxidanylidene-1H-isoquinoline-2-carboxylic acid

Systemtic Name: 3-(4-fluorophenyl)-3-methyl-4-oxidanylidene-1H-isoquinoline-2-carboxylic acid Openeye Name: 3-(4-fluorophenyl)-3-methyl-4-oxo-1H-isoquinoline-2-carboxylic acid CAS Name: 3-(4-fluorophenyl)-3-methyl-4-oxo-1H-isoquinoline-2-carboxylic acid IUPAC Name: 3-(4-fluorophenyl)-3-methyl-4-oxo-1H-isoquinoline-2-carboxylic acid Traditional Name: 3-(4-fluorophenyl)-4-keto-3-methyl-1H-isoquinoline-2-carboxylic acid Formula: C17H14FNO3 MolecularWeight: 299.296363

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C2=CC=CC=C2CN1C(=O)O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1(C(=O)C2=CC=CC=C2CN1C(=O)O)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H14FNO3/c1-17(12-6-8-13(18)9-7-12)15(20)14-5-3-2-4-11(14)10-19(17)16(21)22/h2-9H,10H2,1H3,(H,21,22)