2-[[2-(4-methylphenyl)-2-[3-(phenylmethyl)piperazin-1-yl]ethyl]amino]phenol

Systemtic Name: 2-[[2-(4-methylphenyl)-2-[3-(phenylmethyl)piperazin-1-yl]ethyl]amino]phenol Openeye Name: 2-[[2-(3-benzylpiperazin-1-yl)-2-(p-tolyl)ethyl]amino]phenol CAS Name: 2-[[2-(4-methylphenyl)-2-[3-(phenylmethyl)-1-piperazinyl]ethyl]amino]phenol IUPAC Name: 2-[[2-(3-benzylpiperazin-1-yl)-2-(4-methylphenyl)ethyl]amino]phenol Traditional Name: 2-[[2-(3-benzylpiperazino)-2-(p-tolyl)ethyl]amino]phenol Formula: C26H31N3O MolecularWeight: 401.54384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNC2=CC=CC=C2O)N3CCNC(C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(CNC2=CC=CC=C2O)N3CCNC(C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H31N3O/c1-20-11-13-22(14-12-20)25(18-28-24-9-5-6-10-26(24)30)29-16-15-27-23(19-29)17-21-7-3-2-4-8-21/h2-14,23,25,27-28,30H,15-19H2,1H3