3-(2-chlorophenyl)-2-(4-methylpiperazin-1-yl)-5H-1-benzazepine dihydrochloride

Systemtic Name: 3-(2-chlorophenyl)-2-(4-methylpiperazin-1-yl)-5H-1-benzazepine dihydrochloride Openeye Name: 3-(2-chlorophenyl)-2-(4-methylpiperazin-1-yl)-5H-1-benzazepine dihydrochloride CAS Name: 3-(2-chlorophenyl)-2-(4-methyl-1-piperazinyl)-5H-1-benzazepine dihydrochloride IUPAC Name: 3-(2-chlorophenyl)-2-(4-methylpiperazin-1-yl)-5H-1-benzazepine dihydrochloride Traditional Name: 3-(2-chlorophenyl)-2-(4-methylpiperazino)-5H-1-benzazepine dihydrochloride Formula: C21H24Cl3N3 MolecularWeight: 424.79436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=CC=CC=C3CC=C2C4=CC=CC=C4Cl.Cl.Cl

Isomeric SMILES

CN1CCN(CC1)C2=NC3=CC=CC=C3CC=C2C4=CC=CC=C4Cl.Cl.Cl

InChI

InChI=1S/C21H22ClN3.2ClH/c1-24-12-14-25(15-13-24)21-18(17-7-3-4-8-19(17)22)11-10-16-6-2-5-9-20(16)23-21;;/h2-9,11H,10,12-15H2,1H3;2*1H