7-oxidanyl-5-(4-sulfamoylphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-8-sulfonamide

Systemtic Name: 7-oxidanyl-5-(4-sulfamoylphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-8-sulfonamide Openeye Name: 7-hydroxy-5-(4-sulfamoylphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-8-sulfonamide CAS Name: 7-hydroxy-5-(4-sulfamoylphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-8-sulfonamide IUPAC Name: 7-hydroxy-5-(4-sulfamoylphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-8-sulfonamide Traditional Name: 7-hydroxy-5-(4-sulfamoylphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-8-sulfonamide Formula: C16H19N3O5S2 MolecularWeight: 397.46916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O5S2/c17-25(21,22)12-3-1-10(2-4-12)14-9-19-6-5-11-7-16(26(18,23)24)15(20)8-13(11)14/h1-4,7-8,14,19-20H,5-6,9H2,(H2,17,21,22)(H2,18,23,24)