2-[(2-methoxy-5-methyl-phenyl)methyl]isoquinolin-1-one

Systemtic Name: 2-[(2-methoxy-5-methyl-phenyl)methyl]isoquinolin-1-one Openeye Name: 2-[(2-methoxy-5-methyl-phenyl)methyl]isoquinolin-1-one CAS Name: 2-[(2-methoxy-5-methylphenyl)methyl]-1-isoquinolinone IUPAC Name: 2-[(2-methoxy-5-methylphenyl)methyl]isoquinolin-1-one Traditional Name: 2-(2-methoxy-5-methyl-benzyl)isocarbostyril Formula: C18H17NO2 MolecularWeight: 279.33308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CN2C=CC3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CN2C=CC3=CC=CC=C3C2=O

InChI

InChI=1S/C18H17NO2/c1-13-7-8-17(21-2)15(11-13)12-19-10-9-14-5-3-4-6-16(14)18(19)20/h3-11H,12H2,1-2H3