2-methyl-5-nitro-N-(5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)benzenesulfonamide

Systemtic Name: 2-methyl-5-nitro-N-(5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)benzenesulfonamide Openeye Name: 2-methyl-5-nitro-N-(5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)benzenesulfonamide CAS Name: 2-methyl-5-nitro-N-(5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)benzenesulfonamide IUPAC Name: 2-methyl-5-nitro-N-(5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)benzenesulfonamide Traditional Name: N-(5-keto-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-2-methyl-5-nitro-benzenesulfonamide Formula: C16H15N3O6S MolecularWeight: 377.3718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC3=C(C=C2)OCCNC3=O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC3=C(C=C2)OCCNC3=O

InChI

InChI=1S/C16H15N3O6S/c1-10-2-4-12(19(21)22)9-15(10)26(23,24)18-11-3-5-14-13(8-11)16(20)17-6-7-25-14/h2-5,8-9,18H,6-7H2,1H3,(H,17,20)