3-[(4-chlorophenyl)amino]-4-(phenylcarbonyl)-2H-isoquinolin-1-one

Systemtic Name: 3-[(4-chlorophenyl)amino]-4-(phenylcarbonyl)-2H-isoquinolin-1-one Openeye Name: 4-benzoyl-3-(4-chloroanilino)-2H-isoquinolin-1-one CAS Name: 4-benzoyl-3-(4-chloroanilino)-2H-isoquinolin-1-one IUPAC Name: 4-benzoyl-3-(4-chloroanilino)-2H-isoquinolin-1-one Traditional Name: 4-benzoyl-3-(4-chloroanilino)isocarbostyril Formula: C22H15ClN2O2 MolecularWeight: 374.8197

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(NC(=O)C3=CC=CC=C32)NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(NC(=O)C3=CC=CC=C32)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H15ClN2O2/c23-15-10-12-16(13-11-15)24-21-19(20(26)14-6-2-1-3-7-14)17-8-4-5-9-18(17)22(27)25-21/h1-13H,(H2,24,25,27)