7-(3-oxidanylpiperidin-1-yl)-3-(2-phenylphenyl)-2H-isoquinolin-1-one

Systemtic Name: 7-(3-oxidanylpiperidin-1-yl)-3-(2-phenylphenyl)-2H-isoquinolin-1-one Openeye Name: 7-(3-hydroxy-1-piperidyl)-3-(2-phenylphenyl)-2H-isoquinolin-1-one CAS Name: 7-(3-hydroxy-1-piperidinyl)-3-(2-phenylphenyl)-2H-isoquinolin-1-one IUPAC Name: 7-(3-hydroxypiperidin-1-yl)-3-(2-phenylphenyl)-2H-isoquinolin-1-one Traditional Name: 7-(3-hydroxypiperidino)-3-(2-phenylphenyl)isocarbostyril Formula: C26H24N2O2 MolecularWeight: 396.48096

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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=C4C5=CC=CC=C5)O

Isomeric SMILES

C1CC(CN(C1)C2=CC3=C(C=C2)C=C(NC3=O)C4=CC=CC=C4C5=CC=CC=C5)O

InChI

InChI=1S/C26H24N2O2/c29-21-9-6-14-28(17-21)20-13-12-19-15-25(27-26(30)24(19)16-20)23-11-5-4-10-22(23)18-7-2-1-3-8-18/h1-5,7-8,10-13,15-16,21,29H,6,9,14,17H2,(H,27,30)