(3R,4R)-4-[4-oxidanyl-4-(phenylmethyl)piperidin-1-yl]carbonyl-3-phenyl-2-propan-2-yl-3,4-dihydroisoquinolin-1-one

Systemtic Name: (3R,4R)-4-[4-oxidanyl-4-(phenylmethyl)piperidin-1-yl]carbonyl-3-phenyl-2-propan-2-yl-3,4-dihydroisoquinolin-1-one Openeye Name: (3R,4R)-4-(4-benzyl-4-hydroxy-piperidine-1-carbonyl)-2-isopropyl-3-phenyl-3,4-dihydroisoquinolin-1-one CAS Name: (3R,4R)-4-[[4-hydroxy-4-(phenylmethyl)-1-piperidinyl]-oxomethyl]-3-phenyl-2-propan-2-yl-3,4-dihydroisoquinolin-1-one IUPAC Name: (3R,4R)-4-(4-benzyl-4-hydroxypiperidine-1-carbonyl)-3-phenyl-2-propan-2-yl-3,4-dihydroisoquinolin-1-one Traditional Name: (3R,4R)-4-(4-benzyl-4-hydroxy-piperidine-1-carbonyl)-2-isopropyl-3-phenyl-3,4-dihydroisocarbostyril Formula: C31H34N2O3 MolecularWeight: 482.61326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(C(C2=CC=CC=C2C1=O)C(=O)N3CCC(CC3)(CC4=CC=CC=C4)O)C5=CC=CC=C5

Isomeric SMILES

CC(C)N1[C@H]([C@@H](C2=CC=CC=C2C1=O)C(=O)N3CCC(CC3)(CC4=CC=CC=C4)O)C5=CC=CC=C5

InChI

InChI=1S/C31H34N2O3/c1-22(2)33-28(24-13-7-4-8-14-24)27(25-15-9-10-16-26(25)29(33)34)30(35)32-19-17-31(36,18-20-32)21-23-11-5-3-6-12-23/h3-16,22,27-28,36H,17-21H2,1-2H3/t27-,28+/m1/s1