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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CNCC2=CC=CC=C2)N3CCNC(C3)C4=CC=CC=C4O

Isomeric SMILES

CCC1=CC=C(C=C1)C(CNCC2=CC=CC=C2)N3CCNC(C3)C4=CC=CC=C4O

InChI

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