6-methoxy-2-methyl-4-phenyl-3-[[4-(phenylmethyl)piperidin-1-yl]methyl]isoquinolin-1-one

Systemtic Name: 6-methoxy-2-methyl-4-phenyl-3-[[4-(phenylmethyl)piperidin-1-yl]methyl]isoquinolin-1-one Openeye Name: 3-[(4-benzyl-1-piperidyl)methyl]-6-methoxy-2-methyl-4-phenyl-isoquinolin-1-one CAS Name: 6-methoxy-2-methyl-4-phenyl-3-[[4-(phenylmethyl)-1-piperidinyl]methyl]-1-isoquinolinone IUPAC Name: 3-[(4-benzylpiperidin-1-yl)methyl]-6-methoxy-2-methyl-4-phenylisoquinolin-1-one Traditional Name: 3-[(4-benzylpiperidino)methyl]-6-methoxy-2-methyl-4-phenyl-isocarbostyril Formula: C30H32N2O2 MolecularWeight: 452.58728

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)OC)C3=CC=CC=C3)CN4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)OC)C3=CC=CC=C3)CN4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C30H32N2O2/c1-31-28(21-32-17-15-23(16-18-32)19-22-9-5-3-6-10-22)29(24-11-7-4-8-12-24)27-20-25(34-2)13-14-26(27)30(31)33/h3-14,20,23H,15-19,21H2,1-2H3