1-(5-chloranylbenzo[b][1]benzoxepin-6-yl)-4-[(2-methylphenyl)methyl]piperazine

Systemtic Name: 1-(5-chloranylbenzo[b][1]benzoxepin-6-yl)-4-[(2-methylphenyl)methyl]piperazine Openeye Name: 1-(5-chlorobenzo[b][1]benzoxepin-6-yl)-4-(o-tolylmethyl)piperazine CAS Name: 1-(5-chloro-6-benzo[b][1]benzoxepinyl)-4-[(2-methylphenyl)methyl]piperazine IUPAC Name: 1-(5-chlorobenzo[b][1]benzoxepin-6-yl)-4-[(2-methylphenyl)methyl]piperazine Traditional Name: 1-(5-chlorobenzo[b][1]benzoxepin-6-yl)-4-(2-methylbenzyl)piperazine Formula: C26H25ClN2O MolecularWeight: 416.9425

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C3=C(C4=CC=CC=C4OC5=CC=CC=C53)Cl

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C3=C(C4=CC=CC=C4OC5=CC=CC=C53)Cl

InChI

InChI=1S/C26H25ClN2O/c1-19-8-2-3-9-20(19)18-28-14-16-29(17-15-28)26-22-11-5-7-13-24(22)30-23-12-6-4-10-21(23)25(26)27/h2-13H,14-18H2,1H3