1-[4-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)piperidin-1-yl]piperidin-1-yl]dodecan-1-one

Systemtic Name: 1-[4-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)piperidin-1-yl]piperidin-1-yl]dodecan-1-one Openeye Name: 1-[4-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-piperidyl]-1-piperidyl]dodecan-1-one CAS Name: 1-[4-[4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-1-piperidinyl]-1-piperidinyl]-1-dodecanone IUPAC Name: 1-[4-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidin-1-yl]piperidin-1-yl]dodecan-1-one Traditional Name: 1-[4-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidino]piperidino]dodecan-1-one Formula: C32H51N3O2 MolecularWeight: 509.76624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)N1CCC(CC1)N2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCCCCCCCCCCC(=O)N1CCC(CC1)N2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C32H51N3O2/c1-2-3-4-5-6-7-8-9-10-15-31(36)34-24-19-30(20-25-34)33-21-17-28(18-22-33)32(37)35-23-16-27-13-11-12-14-29(27)26-35/h11-14,28,30H,2-10,15-26H2,1H3