3-azanyl-2-[(4-chlorophenyl)methyl]isoquinolin-1-one

Systemtic Name: 3-azanyl-2-[(4-chlorophenyl)methyl]isoquinolin-1-one Openeye Name: 3-amino-2-[(4-chlorophenyl)methyl]isoquinolin-1-one CAS Name: 3-amino-2-[(4-chlorophenyl)methyl]-1-isoquinolinone IUPAC Name: 3-amino-2-[(4-chlorophenyl)methyl]isoquinolin-1-one Traditional Name: 3-amino-2-(4-chlorobenzyl)isocarbostyril Formula: C16H13ClN2O MolecularWeight: 284.74022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N(C2=O)CC3=CC=C(C=C3)Cl)N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N(C2=O)CC3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C16H13ClN2O/c17-13-7-5-11(6-8-13)10-19-15(18)9-12-3-1-2-4-14(12)16(19)20/h1-9H,10,18H2