2-(4-ethylpiperazin-1-yl)-3-(4-fluorophenyl)-5H-1-benzazepine dihydrochloride

Systemtic Name: 2-(4-ethylpiperazin-1-yl)-3-(4-fluorophenyl)-5H-1-benzazepine dihydrochloride Openeye Name: 2-(4-ethylpiperazin-1-yl)-3-(4-fluorophenyl)-5H-1-benzazepine dihydrochloride CAS Name: 2-(4-ethyl-1-piperazinyl)-3-(4-fluorophenyl)-5H-1-benzazepine dihydrochloride IUPAC Name: 2-(4-ethylpiperazin-1-yl)-3-(4-fluorophenyl)-5H-1-benzazepine dihydrochloride Traditional Name: 2-(4-ethylpiperazino)-3-(4-fluorophenyl)-5H-1-benzazepine dihydrochloride Formula: C22H26Cl2FN3 MolecularWeight: 422.366343

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC3=CC=CC=C3CC=C2C4=CC=C(C=C4)F.Cl.Cl

Isomeric SMILES

CCN1CCN(CC1)C2=NC3=CC=CC=C3CC=C2C4=CC=C(C=C4)F.Cl.Cl

InChI

InChI=1S/C22H24FN3.2ClH/c1-2-25-13-15-26(16-14-25)22-20(17-7-10-19(23)11-8-17)12-9-18-5-3-4-6-21(18)24-22;;/h3-8,10-12H,2,9,13-16H2,1H3;2*1H