2-(4-methylpiperazin-1-yl)-3-[4-(trifluoromethyl)phenyl]-5H-1-benzazepine dihydrochloride

Systemtic Name: 2-(4-methylpiperazin-1-yl)-3-[4-(trifluoromethyl)phenyl]-5H-1-benzazepine dihydrochloride Openeye Name: 2-(4-methylpiperazin-1-yl)-3-[4-(trifluoromethyl)phenyl]-5H-1-benzazepine dihydrochloride CAS Name: 2-(4-methyl-1-piperazinyl)-3-[4-(trifluoromethyl)phenyl]-5H-1-benzazepine dihydrochloride IUPAC Name: 2-(4-methylpiperazin-1-yl)-3-[4-(trifluoromethyl)phenyl]-5H-1-benzazepine dihydrochloride Traditional Name: 2-(4-methylpiperazino)-3-[4-(trifluoromethyl)phenyl]-5H-1-benzazepine dihydrochloride Formula: C22H24Cl2F3N3 MolecularWeight: 458.34727

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=CC=CC=C3CC=C2C4=CC=C(C=C4)C(F)(F)F.Cl.Cl

Isomeric SMILES

CN1CCN(CC1)C2=NC3=CC=CC=C3CC=C2C4=CC=C(C=C4)C(F)(F)F.Cl.Cl

InChI

InChI=1S/C22H22F3N3.2ClH/c1-27-12-14-28(15-13-27)21-19(11-8-17-4-2-3-5-20(17)26-21)16-6-9-18(10-7-16)22(23,24)25;;/h2-7,9-11H,8,12-15H2,1H3;2*1H