4-[9-bromanyl-7,8-bis(oxidanyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl]benzenesulfonamide hydrobromide

Systemtic Name: 4-[9-bromanyl-7,8-bis(oxidanyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl]benzenesulfonamide hydrobromide Openeye Name: 4-(9-bromo-7,8-dihydroxy-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide hydrobromide CAS Name: 4-(9-bromo-7,8-dihydroxy-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide hydrobromide IUPAC Name: 4-(9-bromo-7,8-dihydroxy-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide hydrobromide Traditional Name: 4-(9-bromo-7,8-dihydroxy-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide hydrobromide Formula: C16H18Br2N2O4S MolecularWeight: 494.19812

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(C2=CC(=C(C(=C21)Br)O)O)C3=CC=C(C=C3)S(=O)(=O)N.Br

Isomeric SMILES

C1CNCC(C2=CC(=C(C(=C21)Br)O)O)C3=CC=C(C=C3)S(=O)(=O)N.Br

InChI

InChI=1S/C16H17BrN2O4S.BrH/c17-15-11-5-6-19-8-13(12(11)7-14(20)16(15)21)9-1-3-10(4-2-9)24(18,22)23;/h1-4,7,13,19-21H,5-6,8H2,(H2,18,22,23);1H