7-methyl-3-(4-phenoxyphenyl)-2-(phenylmethyl)isoquinolin-1-one

Systemtic Name: 7-methyl-3-(4-phenoxyphenyl)-2-(phenylmethyl)isoquinolin-1-one Openeye Name: 2-benzyl-7-methyl-3-(4-phenoxyphenyl)isoquinolin-1-one CAS Name: 7-methyl-3-(4-phenoxyphenyl)-2-(phenylmethyl)-1-isoquinolinone IUPAC Name: 2-benzyl-7-methyl-3-(4-phenoxyphenyl)isoquinolin-1-one Traditional Name: 2-benzyl-7-methyl-3-(4-phenoxyphenyl)isocarbostyril Formula: C29H23NO2 MolecularWeight: 417.49842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(N(C2=O)CC3=CC=CC=C3)C4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(N(C2=O)CC3=CC=CC=C3)C4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C29H23NO2/c1-21-12-13-24-19-28(23-14-16-26(17-15-23)32-25-10-6-3-7-11-25)30(29(31)27(24)18-21)20-22-8-4-2-5-9-22/h2-19H,20H2,1H3