N-[4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]phenyl]-2-ethyl-hexanamide

Systemtic Name: N-[4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]phenyl]-2-ethyl-hexanamide Openeye Name: N-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]-2-ethyl-hexanamide CAS Name: N-[4-[4-[(4-tert-butylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-ethylhexanamide IUPAC Name: N-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]-2-ethylhexanamide Traditional Name: N-[4-[4-(4-tert-butylbenzoyl)piperazino]phenyl]-2-ethyl-hexanamide Formula: C29H41N3O2 MolecularWeight: 463.65474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCCCC(CC)C(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C29H41N3O2/c1-6-8-9-22(7-2)27(33)30-25-14-16-26(17-15-25)31-18-20-32(21-19-31)28(34)23-10-12-24(13-11-23)29(3,4)5/h10-17,22H,6-9,18-21H2,1-5H3,(H,30,33)