2-[(4-methylphenyl)methyl]-3-(4-phenoxyphenyl)isoquinolin-1-one

Systemtic Name: 2-[(4-methylphenyl)methyl]-3-(4-phenoxyphenyl)isoquinolin-1-one Openeye Name: 3-(4-phenoxyphenyl)-2-(p-tolylmethyl)isoquinolin-1-one CAS Name: 2-[(4-methylphenyl)methyl]-3-(4-phenoxyphenyl)-1-isoquinolinone IUPAC Name: 2-[(4-methylphenyl)methyl]-3-(4-phenoxyphenyl)isoquinolin-1-one Traditional Name: 2-(4-methylbenzyl)-3-(4-phenoxyphenyl)isocarbostyril Formula: C29H23NO2 MolecularWeight: 417.49842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=CC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=CC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC5=CC=CC=C5

InChI

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