1-[2-tert-butyl-4-[(3,4-dichlorophenyl)-pyridin-2-yl-methyl]piperazin-1-yl]-2-piperidin-4-yl-ethanone

Systemtic Name: 1-[2-tert-butyl-4-[(3,4-dichlorophenyl)-pyridin-2-yl-methyl]piperazin-1-yl]-2-piperidin-4-yl-ethanone Openeye Name: 1-[2-tert-butyl-4-[(3,4-dichlorophenyl)-(2-pyridyl)methyl]piperazin-1-yl]-2-(4-piperidyl)ethanone CAS Name: 1-[2-tert-butyl-4-[(3,4-dichlorophenyl)-(2-pyridinyl)methyl]-1-piperazinyl]-2-(4-piperidinyl)ethanone IUPAC Name: 1-[2-tert-butyl-4-[(3,4-dichlorophenyl)-pyridin-2-ylmethyl]piperazin-1-yl]-2-piperidin-4-ylethanone Traditional Name: 1-[2-tert-butyl-4-[(3,4-dichlorophenyl)-(2-pyridyl)methyl]piperazino]-2-(4-piperidyl)ethanone Formula: C27H36Cl2N4O MolecularWeight: 503.50694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CN(CCN1C(=O)CC2CCNCC2)C(C3=CC(=C(C=C3)Cl)Cl)C4=CC=CC=N4

Isomeric SMILES

CC(C)(C)C1CN(CCN1C(=O)CC2CCNCC2)C(C3=CC(=C(C=C3)Cl)Cl)C4=CC=CC=N4

InChI

InChI=1S/C27H36Cl2N4O/c1-27(2,3)24-18-32(14-15-33(24)25(34)16-19-9-12-30-13-10-19)26(23-6-4-5-11-31-23)20-7-8-21(28)22(29)17-20/h4-8,11,17,19,24,26,30H,9-10,12-16,18H2,1-3H3