1-butyl-5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-6-(4-methoxyphenyl)piperidin-2-one

Systemtic Name: 1-butyl-5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-6-(4-methoxyphenyl)piperidin-2-one Openeye Name: 1-butyl-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-6-(4-methoxyphenyl)piperidin-2-one CAS Name: 1-butyl-5-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-6-(4-methoxyphenyl)-2-piperidinone IUPAC Name: 1-butyl-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-6-(4-methoxyphenyl)piperidin-2-one Traditional Name: 1-butyl-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-6-(4-methoxyphenyl)-2-piperidone Formula: C26H32N2O3 MolecularWeight: 420.54388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(CCC1=O)C(=O)N2CCC3=CC=CC=C3C2)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCCN1C(C(CCC1=O)C(=O)N2CCC3=CC=CC=C3C2)C4=CC=C(C=C4)OC

InChI

InChI=1S/C26H32N2O3/c1-3-4-16-28-24(29)14-13-23(25(28)20-9-11-22(31-2)12-10-20)26(30)27-17-15-19-7-5-6-8-21(19)18-27/h5-12,23,25H,3-4,13-18H2,1-2H3