9-chloranyl-5-(4-chlorophenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol bromide

Systemtic Name: 9-chloranyl-5-(4-chlorophenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol bromide Openeye Name: 9-chloro-5-(4-chlorophenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol bromide CAS Name: 9-chloro-5-(4-chlorophenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol bromide IUPAC Name: 9-chloro-5-(4-chlorophenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol bromide Traditional Name: 9-chloro-5-(4-chlorophenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol bromide Formula: C16H15BrCl2NO2- MolecularWeight: 404.1058

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(C2=CC(=C(C(=C21)Cl)O)O)C3=CC=C(C=C3)Cl.[Br-]

Isomeric SMILES

C1CNCC(C2=CC(=C(C(=C21)Cl)O)O)C3=CC=C(C=C3)Cl.[Br-]

InChI

InChI=1S/C16H15Cl2NO2.BrH/c17-10-3-1-9(2-4-10)13-8-19-6-5-11-12(13)7-14(20)16(21)15(11)18;/h1-4,7,13,19-21H,5-6,8H2;1H/p-1