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

Systemtic Name: 2-(2-methoxyethyl)-3-phenyl-4-[4-(phenylmethyl)piperidin-1-yl]carbonyl-3,4-dihydroisoquinolin-1-one Openeye Name: 4-(4-benzylpiperidine-1-carbonyl)-2-(2-methoxyethyl)-3-phenyl-3,4-dihydroisoquinolin-1-one CAS Name: 2-(2-methoxyethyl)-4-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-3-phenyl-3,4-dihydroisoquinolin-1-one IUPAC Name: 4-(4-benzylpiperidine-1-carbonyl)-2-(2-methoxyethyl)-3-phenyl-3,4-dihydroisoquinolin-1-one Traditional Name: 4-(4-benzylpiperidine-1-carbonyl)-2-(2-methoxyethyl)-3-phenyl-3,4-dihydroisocarbostyril Formula: C31H34N2O3 MolecularWeight: 482.61326

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(C(C2=CC=CC=C2C1=O)C(=O)N3CCC(CC3)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COCCN1C(C(C2=CC=CC=C2C1=O)C(=O)N3CCC(CC3)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H34N2O3/c1-36-21-20-33-29(25-12-6-3-7-13-25)28(26-14-8-9-15-27(26)30(33)34)31(35)32-18-16-24(17-19-32)22-23-10-4-2-5-11-23/h2-15,24,28-29H,16-22H2,1H3