3-chloranyl-N-[3-oxidanylidene-4-(1-phenylpropyl)-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide

Systemtic Name: 3-chloranyl-N-[3-oxidanylidene-4-(1-phenylpropyl)-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Openeye Name: 3-chloro-N-[3-oxo-4-(1-phenylpropyl)-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide CAS Name: 3-chloro-N-[3-oxo-4-(1-phenylpropyl)-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide IUPAC Name: 3-chloro-N-[3-oxo-4-(1-phenylpropyl)-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Traditional Name: 3-chloro-N-[3-keto-4-(1-phenylpropyl)-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Formula: C24H23ClN2O4S MolecularWeight: 470.96842

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)N2CC3=C(C=CC(=C3)NS(=O)(=O)C4=CC(=CC=C4)Cl)OCC2=O

Isomeric SMILES

CCC(C1=CC=CC=C1)N2CC3=C(C=CC(=C3)NS(=O)(=O)C4=CC(=CC=C4)Cl)OCC2=O

InChI

InChI=1S/C24H23ClN2O4S/c1-2-22(17-7-4-3-5-8-17)27-15-18-13-20(11-12-23(18)31-16-24(27)28)26-32(29,30)21-10-6-9-19(25)14-21/h3-14,22,26H,2,15-16H2,1H3