1-[4-[bis(4-chlorophenyl)methyl]-2-tert-butyl-piperazin-1-yl]-2-piperidin-4-yl-ethanone

Systemtic Name: 1-[4-[bis(4-chlorophenyl)methyl]-2-tert-butyl-piperazin-1-yl]-2-piperidin-4-yl-ethanone Openeye Name: 1-[4-[bis(4-chlorophenyl)methyl]-2-tert-butyl-piperazin-1-yl]-2-(4-piperidyl)ethanone CAS Name: 1-[4-[bis(4-chlorophenyl)methyl]-2-tert-butyl-1-piperazinyl]-2-(4-piperidinyl)ethanone IUPAC Name: 1-[4-[bis(4-chlorophenyl)methyl]-2-tert-butylpiperazin-1-yl]-2-piperidin-4-ylethanone Traditional Name: 1-[4-[bis(4-chlorophenyl)methyl]-2-tert-butyl-piperazino]-2-(4-piperidyl)ethanone Formula: C28H37Cl2N3O MolecularWeight: 502.51888

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)C4=CC=C(C=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C28H37Cl2N3O/c1-28(2,3)25-19-32(16-17-33(25)26(34)18-20-12-14-31-15-13-20)27(21-4-8-23(29)9-5-21)22-6-10-24(30)11-7-22/h4-11,20,25,27,31H,12-19H2,1-3H3