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

Systemtic Name: 2-[[2-[3-(phenylmethyl)piperazin-1-yl]-2-(4-propylphenyl)ethyl]amino]phenol Openeye Name: 2-[[2-(3-benzylpiperazin-1-yl)-2-(4-propylphenyl)ethyl]amino]phenol CAS Name: 2-[[2-[3-(phenylmethyl)-1-piperazinyl]-2-(4-propylphenyl)ethyl]amino]phenol IUPAC Name: 2-[[2-(3-benzylpiperazin-1-yl)-2-(4-propylphenyl)ethyl]amino]phenol Traditional Name: 2-[[2-(3-benzylpiperazino)-2-(4-propylphenyl)ethyl]amino]phenol Formula: C28H35N3O MolecularWeight: 429.597

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(CNC2=CC=CC=C2O)N3CCNC(C3)CC4=CC=CC=C4

Isomeric SMILES

CCCC1=CC=C(C=C1)C(CNC2=CC=CC=C2O)N3CCNC(C3)CC4=CC=CC=C4

InChI

InChI=1S/C28H35N3O/c1-2-8-22-13-15-24(16-14-22)27(20-30-26-11-6-7-12-28(26)32)31-18-17-29-25(21-31)19-23-9-4-3-5-10-23/h3-7,9-16,25,27,29-30,32H,2,8,17-21H2,1H3