4-[(3,4-dimethoxyphenyl)methyl]-1-phenyl-2H-isoquinolin-3-one

Systemtic Name: 4-[(3,4-dimethoxyphenyl)methyl]-1-phenyl-2H-isoquinolin-3-one Openeye Name: 4-[(3,4-dimethoxyphenyl)methyl]-1-phenyl-2H-isoquinolin-3-one CAS Name: 4-[(3,4-dimethoxyphenyl)methyl]-1-phenyl-2H-isoquinolin-3-one IUPAC Name: 4-[(3,4-dimethoxyphenyl)methyl]-1-phenyl-2H-isoquinolin-3-one Traditional Name: 1-phenyl-4-veratryl-3-isoquinolone Formula: C24H21NO3 MolecularWeight: 371.42844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=C3C=CC=CC3=C(NC2=O)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=C3C=CC=CC3=C(NC2=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C24H21NO3/c1-27-21-13-12-16(15-22(21)28-2)14-20-18-10-6-7-11-19(18)23(25-24(20)26)17-8-4-3-5-9-17/h3-13,15H,14H2,1-2H3,(H,25,26)