2-(3-chloranyl-2-methyl-propyl)-4-phenyl-isoquinolin-1-one

Systemtic Name: 2-(3-chloranyl-2-methyl-propyl)-4-phenyl-isoquinolin-1-one Openeye Name: 2-(3-chloro-2-methyl-propyl)-4-phenyl-isoquinolin-1-one CAS Name: 2-(3-chloro-2-methylpropyl)-4-phenyl-1-isoquinolinone IUPAC Name: 2-(3-chloro-2-methylpropyl)-4-phenylisoquinolin-1-one Traditional Name: 2-(3-chloro-2-methyl-propyl)-4-phenyl-isocarbostyril Formula: C19H18ClNO MolecularWeight: 311.80532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)CCl

Isomeric SMILES

CC(CN1C=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)CCl

InChI

InChI=1S/C19H18ClNO/c1-14(11-20)12-21-13-18(15-7-3-2-4-8-15)16-9-5-6-10-17(16)19(21)22/h2-10,13-14H,11-12H2,1H3