6-chloranyl-2-(methylamino)-4-(4-methylphenyl)-1-oxidanylidene-isoquinoline-3-carboxylic acid

Systemtic Name: 6-chloranyl-2-(methylamino)-4-(4-methylphenyl)-1-oxidanylidene-isoquinoline-3-carboxylic acid Openeye Name: 6-chloro-2-(methylamino)-1-oxo-4-(p-tolyl)isoquinoline-3-carboxylic acid CAS Name: 6-chloro-2-(methylamino)-4-(4-methylphenyl)-1-oxo-3-isoquinolinecarboxylic acid IUPAC Name: 6-chloro-2-(methylamino)-4-(4-methylphenyl)-1-oxoisoquinoline-3-carboxylic acid Traditional Name: 6-chloro-1-keto-2-(methylamino)-4-(p-tolyl)isoquinoline-3-carboxylic acid Formula: C18H15ClN2O3 MolecularWeight: 342.7763

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClN2O3/c1-10-3-5-11(6-4-10)15-14-9-12(19)7-8-13(14)17(22)21(20-2)16(15)18(23)24/h3-9,20H,1-2H3,(H,23,24)