5-chloranyl-2-methyl-3-phenyl-isoindole-1-carboxylic acid

Systemtic Name: 5-chloranyl-2-methyl-3-phenyl-isoindole-1-carboxylic acid Openeye Name: 5-chloro-2-methyl-3-phenyl-isoindole-1-carboxylic acid CAS Name: 5-chloro-2-methyl-3-phenyl-1-isoindolecarboxylic acid IUPAC Name: 5-chloro-2-methyl-3-phenylisoindole-1-carboxylic acid Traditional Name: 5-chloro-2-methyl-3-phenyl-isoindole-1-carboxylic acid Formula: C16H12ClNO2 MolecularWeight: 285.72498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C2C=C(C=CC2=C1C(=O)O)Cl)C3=CC=CC=C3

Isomeric SMILES

CN1C(=C2C=C(C=CC2=C1C(=O)O)Cl)C3=CC=CC=C3

InChI

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