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

Systemtic Name: 2-[7,8-bis(oxidanyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl]benzenesulfonamide Openeye Name: 2-(7,8-dihydroxy-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide CAS Name: 2-(7,8-dihydroxy-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide IUPAC Name: 2-(7,8-dihydroxy-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide Traditional Name: 2-(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=CC=C3S(=O)(=O)N

Isomeric SMILES

C1CNCC(C2=CC(=C(C=C21)O)O)C3=CC=CC=C3S(=O)(=O)N

InChI

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