1-[4-[1-cyclopentyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-2-methyl-butan-1-one

Systemtic Name: 1-[4-[1-cyclopentyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-2-methyl-butan-1-one Openeye Name: 1-[4-[1-cyclopentyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]piperazin-1-yl]-2-methyl-butan-1-one CAS Name: 1-[4-[1-cyclopentyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-1-piperazinyl]-2-methyl-1-butanone IUPAC Name: 1-[4-[1-cyclopentyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]piperazin-1-yl]-2-methylbutan-1-one Traditional Name: 1-[4-[1-cyclopentyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]piperazino]-2-methyl-butan-1-one Formula: C25H37N3O2 MolecularWeight: 411.58018

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)N1CCN(CC1)C(C2CCCC2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCC(C)C(=O)N1CCN(CC1)C(C2CCCC2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C25H37N3O2/c1-3-19(2)24(29)27-16-14-26(15-17-27)23(21-9-5-6-10-21)25(30)28-13-12-20-8-4-7-11-22(20)18-28/h4,7-8,11,19,21,23H,3,5-6,9-10,12-18H2,1-2H3