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

Systemtic Name: 2-[[2-(4-ethylphenyl)-2-[3-(phenylmethyl)piperazin-1-yl]ethyl]amino]phenol Openeye Name: 2-[[2-(3-benzylpiperazin-1-yl)-2-(4-ethylphenyl)ethyl]amino]phenol CAS Name: 2-[[2-(4-ethylphenyl)-2-[3-(phenylmethyl)-1-piperazinyl]ethyl]amino]phenol IUPAC Name: 2-[[2-(3-benzylpiperazin-1-yl)-2-(4-ethylphenyl)ethyl]amino]phenol Traditional Name: 2-[[2-(3-benzylpiperazino)-2-(4-ethylphenyl)ethyl]amino]phenol Formula: C27H33N3O MolecularWeight: 415.57042

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CNC2=CC=CC=C2O)N3CCNC(C3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)C(CNC2=CC=CC=C2O)N3CCNC(C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H33N3O/c1-2-21-12-14-23(15-13-21)26(19-29-25-10-6-7-11-27(25)31)30-17-16-28-24(20-30)18-22-8-4-3-5-9-22/h3-15,24,26,28-29,31H,2,16-20H2,1H3