7-[3-(hydroxymethyl)piperidin-1-yl]-3-phenyl-2H-isoquinolin-1-one

Systemtic Name: 7-[3-(hydroxymethyl)piperidin-1-yl]-3-phenyl-2H-isoquinolin-1-one Openeye Name: 7-[3-(hydroxymethyl)-1-piperidyl]-3-phenyl-2H-isoquinolin-1-one CAS Name: 7-[3-(hydroxymethyl)-1-piperidinyl]-3-phenyl-2H-isoquinolin-1-one IUPAC Name: 7-[3-(hydroxymethyl)piperidin-1-yl]-3-phenyl-2H-isoquinolin-1-one Traditional Name: 7-(3-methylolpiperidino)-3-phenyl-isocarbostyril Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=CC3=C(C=C2)C=C(NC3=O)C4=CC=CC=C4)CO

Isomeric SMILES

C1CC(CN(C1)C2=CC3=C(C=C2)C=C(NC3=O)C4=CC=CC=C4)CO

InChI

InChI=1S/C21H22N2O2/c24-14-15-5-4-10-23(13-15)18-9-8-17-11-20(16-6-2-1-3-7-16)22-21(25)19(17)12-18/h1-3,6-9,11-12,15,24H,4-5,10,13-14H2,(H,22,25)