N-chloranyl-2-[4-(2-methylpropyl)phenyl]-2-[3-(phenylmethyl)piperazin-1-yl]ethanamine

Systemtic Name: N-chloranyl-2-[4-(2-methylpropyl)phenyl]-2-[3-(phenylmethyl)piperazin-1-yl]ethanamine Openeye Name: 2-(3-benzylpiperazin-1-yl)-N-chloro-2-(4-isobutylphenyl)ethanamine CAS Name: N-chloro-2-[4-(2-methylpropyl)phenyl]-2-[3-(phenylmethyl)-1-piperazinyl]ethanamine IUPAC Name: 2-(3-benzylpiperazin-1-yl)-N-chloro-2-[4-(2-methylpropyl)phenyl]ethanamine Traditional Name: [2-(3-benzylpiperazino)-2-(4-isobutylphenyl)ethyl]-chloro-amine Formula: C23H32ClN3 MolecularWeight: 385.97328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(CNCl)N2CCNC(C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(CNCl)N2CCNC(C2)CC3=CC=CC=C3

InChI

InChI=1S/C23H32ClN3/c1-18(2)14-20-8-10-21(11-9-20)23(16-26-24)27-13-12-25-22(17-27)15-19-6-4-3-5-7-19/h3-11,18,22-23,25-26H,12-17H2,1-2H3