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

Systemtic Name: 1-[2-tert-butyl-4-[2-cyclopropyl-1-(3,4-dichlorophenyl)ethyl]piperazin-1-yl]-2-piperidin-4-yl-ethanone Openeye Name: 1-[2-tert-butyl-4-[2-cyclopropyl-1-(3,4-dichlorophenyl)ethyl]piperazin-1-yl]-2-(4-piperidyl)ethanone CAS Name: 1-[2-tert-butyl-4-[2-cyclopropyl-1-(3,4-dichlorophenyl)ethyl]-1-piperazinyl]-2-(4-piperidinyl)ethanone IUPAC Name: 1-[2-tert-butyl-4-[2-cyclopropyl-1-(3,4-dichlorophenyl)ethyl]piperazin-1-yl]-2-piperidin-4-ylethanone Traditional Name: 1-[2-tert-butyl-4-[2-cyclopropyl-1-(3,4-dichlorophenyl)ethyl]piperazino]-2-(4-piperidyl)ethanone Formula: C26H39Cl2N3O MolecularWeight: 480.51336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CN(CCN1C(=O)CC2CCNCC2)C(CC3CC3)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CC(C)(C)C1CN(CCN1C(=O)CC2CCNCC2)C(CC3CC3)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C26H39Cl2N3O/c1-26(2,3)24-17-30(12-13-31(24)25(32)15-19-8-10-29-11-9-19)23(14-18-4-5-18)20-6-7-21(27)22(28)16-20/h6-7,16,18-19,23-24,29H,4-5,8-15,17H2,1-3H3