4-iodanyl-3-phenyl-2-(phenylmethyl)isoquinolin-1-one

Systemtic Name: 4-iodanyl-3-phenyl-2-(phenylmethyl)isoquinolin-1-one Openeye Name: 2-benzyl-4-iodo-3-phenyl-isoquinolin-1-one CAS Name: 4-iodo-3-phenyl-2-(phenylmethyl)-1-isoquinolinone IUPAC Name: 2-benzyl-4-iodo-3-phenylisoquinolin-1-one Traditional Name: 2-benzyl-4-iodo-3-phenyl-isocarbostyril Formula: C22H16INO MolecularWeight: 437.27301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=C(C3=CC=CC=C3C2=O)I)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=C(C3=CC=CC=C3C2=O)I)C4=CC=CC=C4

InChI

InChI=1S/C22H16INO/c23-20-18-13-7-8-14-19(18)22(25)24(15-16-9-3-1-4-10-16)21(20)17-11-5-2-6-12-17/h1-14H,15H2