6-chloranyl-1-(4-propan-2-ylsulfonylphenyl)-2,3,4,5-tetrahydro-1-benzazepine-7,8-diol hydrobromide

Systemtic Name: 6-chloranyl-1-(4-propan-2-ylsulfonylphenyl)-2,3,4,5-tetrahydro-1-benzazepine-7,8-diol hydrobromide Openeye Name: 6-chloro-1-(4-isopropylsulfonylphenyl)-2,3,4,5-tetrahydro-1-benzazepine-7,8-diol hydrobromide CAS Name: 6-chloro-1-(4-propan-2-ylsulfonylphenyl)-2,3,4,5-tetrahydro-1-benzazepine-7,8-diol hydrobromide IUPAC Name: 6-chloro-1-(4-propan-2-ylsulfonylphenyl)-2,3,4,5-tetrahydro-1-benzazepine-7,8-diol hydrobromide Traditional Name: 6-chloro-1-(4-isopropylsulfonylphenyl)-2,3,4,5-tetrahydro-1-benzazepine-7,8-diol hydrobromide Formula: C19H23BrClNO4S MolecularWeight: 476.81222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC=C(C=C1)N2CCCCC3=C(C(=C(C=C32)O)O)Cl.Br

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC=C(C=C1)N2CCCCC3=C(C(=C(C=C32)O)O)Cl.Br

InChI

InChI=1S/C19H22ClNO4S.BrH/c1-12(2)26(24,25)14-8-6-13(7-9-14)21-10-4-3-5-15-16(21)11-17(22)19(23)18(15)20;/h6-9,11-12,22-23H,3-5,10H2,1-2H3;1H