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

Systemtic Name: 4-[9-methyl-7,8-bis(oxidanyl)-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl]benzenesulfonamide Openeye Name: 4-(7,8-dihydroxy-9-methyl-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide CAS Name: 4-(7,8-dihydroxy-9-methyl-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide IUPAC Name: 4-(7,8-dihydroxy-9-methyl-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide Traditional Name: 4-(7,8-dihydroxy-9-methyl-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCNCC(C2=CC(=C1O)O)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=C2CCNCC(C2=CC(=C1O)O)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C17H20N2O4S/c1-10-13-6-7-19-9-15(14(13)8-16(20)17(10)21)11-2-4-12(5-3-11)24(18,22)23/h2-5,8,15,19-21H,6-7,9H2,1H3,(H2,18,22,23)