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

Systemtic Name: 9-chloranyl-3-ethyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol hydrobromide Openeye Name: 9-chloro-3-ethyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol hydrobromide CAS Name: 9-chloro-3-ethyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol hydrobromide IUPAC Name: 9-chloro-3-ethyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol hydrobromide Traditional Name: 9-chloro-3-ethyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol hydrobromide Formula: C18H21BrClNO2 MolecularWeight: 398.72184

Click to see the large picture

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