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

Systemtic Name: 2,6,7-trimethyl-4-(2-methylphenyl)-1-oxidanylidene-isoquinoline-3-carboxylic acid Openeye Name: 2,6,7-trimethyl-4-(o-tolyl)-1-oxo-isoquinoline-3-carboxylic acid CAS Name: 2,6,7-trimethyl-4-(2-methylphenyl)-1-oxo-3-isoquinolinecarboxylic acid IUPAC Name: 2,6,7-trimethyl-4-(2-methylphenyl)-1-oxoisoquinoline-3-carboxylic acid Traditional Name: 1-keto-2,6,7-trimethyl-4-(o-tolyl)isoquinoline-3-carboxylic acid Formula: C20H19NO3 MolecularWeight: 321.36976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(N(C(=O)C3=CC(=C(C=C32)C)C)C)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=C(N(C(=O)C3=CC(=C(C=C32)C)C)C)C(=O)O

InChI

InChI=1S/C20H19NO3/c1-11-7-5-6-8-14(11)17-15-9-12(2)13(3)10-16(15)19(22)21(4)18(17)20(23)24/h5-10H,1-4H3,(H,23,24)