4-[4-[[methyl(phenethyl)amino]methyl]phenyl]-5-oxidanyl-2H-isoquinolin-1-one

Systemtic Name: 4-[4-[[methyl(phenethyl)amino]methyl]phenyl]-5-oxidanyl-2H-isoquinolin-1-one Openeye Name: 5-hydroxy-4-[4-[[methyl(phenethyl)amino]methyl]phenyl]-2H-isoquinolin-1-one CAS Name: 5-hydroxy-4-[4-[[methyl(phenethyl)amino]methyl]phenyl]-2H-isoquinolin-1-one IUPAC Name: 5-hydroxy-4-[4-[[methyl(phenethyl)amino]methyl]phenyl]-2H-isoquinolin-1-one Traditional Name: 5-hydroxy-4-[4-[[methyl(phenethyl)amino]methyl]phenyl]isocarbostyril Formula: C25H24N2O2 MolecularWeight: 384.47026

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)CC2=CC=C(C=C2)C3=CNC(=O)C4=C3C(=CC=C4)O

Isomeric SMILES

CN(CCC1=CC=CC=C1)CC2=CC=C(C=C2)C3=CNC(=O)C4=C3C(=CC=C4)O

InChI

InChI=1S/C25H24N2O2/c1-27(15-14-18-6-3-2-4-7-18)17-19-10-12-20(13-11-19)22-16-26-25(29)21-8-5-9-23(28)24(21)22/h2-13,16,28H,14-15,17H2,1H3,(H,26,29)