1-[4-chloranyl-3-(2-methylphenyl)-5-(pyridin-4-ylmethoxymethyl)phenyl]-4-ethyl-piperazine

Systemtic Name: 1-[4-chloranyl-3-(2-methylphenyl)-5-(pyridin-4-ylmethoxymethyl)phenyl]-4-ethyl-piperazine Openeye Name: 1-[4-chloro-3-(o-tolyl)-5-(4-pyridylmethoxymethyl)phenyl]-4-ethyl-piperazine CAS Name: 1-[4-chloro-3-(2-methylphenyl)-5-(pyridin-4-ylmethoxymethyl)phenyl]-4-ethylpiperazine IUPAC Name: 1-[4-chloro-3-(2-methylphenyl)-5-(pyridin-4-ylmethoxymethyl)phenyl]-4-ethylpiperazine Traditional Name: 1-[4-chloro-3-(o-tolyl)-5-(4-pyridylmethoxymethyl)phenyl]-4-ethyl-piperazine Formula: C26H30ClN3O MolecularWeight: 435.9889

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C(=C2)C3=CC=CC=C3C)Cl)COCC4=CC=NC=C4

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C(=C2)C3=CC=CC=C3C)Cl)COCC4=CC=NC=C4

InChI

InChI=1S/C26H30ClN3O/c1-3-29-12-14-30(15-13-29)23-16-22(19-31-18-21-8-10-28-11-9-21)26(27)25(17-23)24-7-5-4-6-20(24)2/h4-11,16-17H,3,12-15,18-19H2,1-2H3