1-(3-chloranyl-5,6-dihydrobenzo[b][1]benzoxepin-6-yl)-4-methyl-piperazine dihydrochloride

Systemtic Name: 1-(3-chloranyl-5,6-dihydrobenzo[b][1]benzoxepin-6-yl)-4-methyl-piperazine dihydrochloride Openeye Name: 1-(3-chloro-5,6-dihydrobenzo[b][1]benzoxepin-6-yl)-4-methyl-piperazine dihydrochloride CAS Name: 1-(3-chloro-5,6-dihydrobenzo[b][1]benzoxepin-6-yl)-4-methylpiperazine dihydrochloride IUPAC Name: 1-(3-chloro-5,6-dihydrobenzo[b][1]benzoxepin-6-yl)-4-methylpiperazine dihydrochloride Traditional Name: 1-(3-chloro-5,6-dihydrobenzo[b][1]benzoxepin-6-yl)-4-methyl-piperazine dihydrochloride Formula: C19H23Cl3N2O MolecularWeight: 401.75772

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CC3=C(C=CC(=C3)Cl)OC4=CC=CC=C24.Cl.Cl

Isomeric SMILES

CN1CCN(CC1)C2CC3=C(C=CC(=C3)Cl)OC4=CC=CC=C24.Cl.Cl

InChI

InChI=1S/C19H21ClN2O.2ClH/c1-21-8-10-22(11-9-21)17-13-14-12-15(20)6-7-18(14)23-19-5-3-2-4-16(17)19;;/h2-7,12,17H,8-11,13H2,1H3;2*1H