9-chloranyl-3-ethyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol bromide

Systemtic Name: 9-chloranyl-3-ethyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol bromide Openeye Name: 9-chloro-3-ethyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol bromide CAS Name: 9-chloro-3-ethyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol bromide IUPAC Name: 9-chloro-3-ethyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol bromide Traditional Name: 9-chloro-3-ethyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol bromide Formula: C18H20BrClNO2- MolecularWeight: 397.7139

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=C(C(=C(C=C2C(C1)C3=CC=CC=C3)O)O)Cl.[Br-]

Isomeric SMILES

CCN1CCC2=C(C(=C(C=C2C(C1)C3=CC=CC=C3)O)O)Cl.[Br-]

InChI

InChI=1S/C18H20ClNO2.BrH/c1-2-20-9-8-13-14(10-16(21)18(22)17(13)19)15(11-20)12-6-4-3-5-7-12;/h3-7,10,15,21-22H,2,8-9,11H2,1H3;1H/p-1