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

Systemtic Name: 4-[7,8-bis(oxidanyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl]benzenesulfonamide Openeye Name: 4-(7,8-dihydroxy-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide CAS Name: 4-(7,8-dihydroxy-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide IUPAC Name: 4-(7,8-dihydroxy-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide Traditional Name: 4-(7,8-dihydroxy-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O4S/c17-23(21,22)12-3-1-10(2-4-12)14-9-18-6-5-11-7-15(19)16(20)8-13(11)14/h1-4,7-8,14,18-20H,5-6,9H2,(H2,17,21,22)