2-[4-[7-bromanyl-3-(4-chlorophenyl)-5H-1-benzazepin-2-yl]piperazin-1-yl]ethanol dihydrochloride

Systemtic Name: 2-[4-[7-bromanyl-3-(4-chlorophenyl)-5H-1-benzazepin-2-yl]piperazin-1-yl]ethanol dihydrochloride Openeye Name: 2-[4-[7-bromo-3-(4-chlorophenyl)-5H-1-benzazepin-2-yl]piperazin-1-yl]ethanol dihydrochloride CAS Name: 2-[4-[7-bromo-3-(4-chlorophenyl)-5H-1-benzazepin-2-yl]-1-piperazinyl]ethanol dihydrochloride IUPAC Name: 2-[4-[7-bromo-3-(4-chlorophenyl)-5H-1-benzazepin-2-yl]piperazin-1-yl]ethanol dihydrochloride Traditional Name: 2-[4-[7-bromo-3-(4-chlorophenyl)-5H-1-benzazepin-2-yl]piperazino]ethanol dihydrochloride Formula: C22H25BrCl3N3O MolecularWeight: 533.7164

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=NC3=C(CC=C2C4=CC=C(C=C4)Cl)C=C(C=C3)Br.Cl.Cl

Isomeric SMILES

C1CN(CCN1CCO)C2=NC3=C(CC=C2C4=CC=C(C=C4)Cl)C=C(C=C3)Br.Cl.Cl

InChI

InChI=1S/C22H23BrClN3O.2ClH/c23-18-4-8-21-17(15-18)3-7-20(16-1-5-19(24)6-2-16)22(25-21)27-11-9-26(10-12-27)13-14-28;;/h1-2,4-8,15,28H,3,9-14H2;2*1H