1-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanyl-butanoyl]-N-(1,7-diphenylheptan-4-yl)piperidine-4-carboxamide

Systemtic Name: 1-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanyl-butanoyl]-N-(1,7-diphenylheptan-4-yl)piperidine-4-carboxamide Openeye Name: 1-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxy-butanoyl]-N-[4-phenyl-1-(3-phenylpropyl)butyl]piperidine-4-carboxamide CAS Name: 1-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxy-1-oxobutyl]-N-(1,7-diphenylheptan-4-yl)-4-piperidinecarboxamide IUPAC Name: 1-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxybutanoyl]-N-(1,7-diphenylheptan-4-yl)piperidine-4-carboxamide Traditional Name: 1-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-hydroxy-butanoyl]-N-[4-phenyl-1-(3-phenylpropyl)butyl]isonipecotamide Formula: C38H49N3O3 MolecularWeight: 595.81396

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC(CCCC2=CC=CC=C2)CCCC3=CC=CC=C3)C(=O)CC(CN4CCC5=CC=CC=C5C4)O

Isomeric SMILES

C1CN(CCC1C(=O)NC(CCCC2=CC=CC=C2)CCCC3=CC=CC=C3)C(=O)CC(CN4CCC5=CC=CC=C5C4)O

InChI

InChI=1S/C38H49N3O3/c42-36(29-40-24-21-32-17-7-8-18-34(32)28-40)27-37(43)41-25-22-33(23-26-41)38(44)39-35(19-9-15-30-11-3-1-4-12-30)20-10-16-31-13-5-2-6-14-31/h1-8,11-14,17-18,33,35-36,42H,9-10,15-16,19-29H2,(H,39,44)