3-(4-chlorophenyl)-5-methyl-2H-isoindole-1-carboxylic acid

Systemtic Name: 3-(4-chlorophenyl)-5-methyl-2H-isoindole-1-carboxylic acid Openeye Name: 3-(4-chlorophenyl)-5-methyl-2H-isoindole-1-carboxylic acid CAS Name: 3-(4-chlorophenyl)-5-methyl-2H-isoindole-1-carboxylic acid IUPAC Name: 3-(4-chlorophenyl)-5-methyl-2H-isoindole-1-carboxylic acid Traditional Name: 3-(4-chlorophenyl)-5-methyl-2H-isoindole-1-carboxylic acid Formula: C16H12ClNO2 MolecularWeight: 285.72498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(NC(=C2C=C1)C(=O)O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC2=C(NC(=C2C=C1)C(=O)O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H12ClNO2/c1-9-2-7-12-13(8-9)14(18-15(12)16(19)20)10-3-5-11(17)6-4-10/h2-8,18H,1H3,(H,19,20)