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

Systemtic Name: 4-[7,8-bis(oxidanyl)-9-propyl-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl]benzenesulfonamide Openeye Name: 4-(7,8-dihydroxy-9-propyl-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide CAS Name: 4-(7,8-dihydroxy-9-propyl-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide IUPAC Name: 4-(7,8-dihydroxy-9-propyl-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide Traditional Name: 4-(7,8-dihydroxy-9-propyl-2,3,4,5-tetrahydro-1H-3-benzazepin-5-yl)benzenesulfonamide Formula: C19H24N2O4S MolecularWeight: 376.46986

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2CCNCC(C2=CC(=C1O)O)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CCCC1=C2CCNCC(C2=CC(=C1O)O)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C19H24N2O4S/c1-2-3-15-14-8-9-21-11-17(16(14)10-18(22)19(15)23)12-4-6-13(7-5-12)26(20,24)25/h4-7,10,17,21-23H,2-3,8-9,11H2,1H3,(H2,20,24,25)