N-(4-chloranyl-3-nitro-phenyl)-4-ethanoyl-2,3-dihydro-1,4-benzothiazine-6-sulfonamide

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-4-ethanoyl-2,3-dihydro-1,4-benzothiazine-6-sulfonamide Openeye Name: 4-acetyl-N-(4-chloro-3-nitro-phenyl)-2,3-dihydro-1,4-benzothiazine-6-sulfonamide CAS Name: 4-acetyl-N-(4-chloro-3-nitrophenyl)-2,3-dihydro-1,4-benzothiazine-6-sulfonamide IUPAC Name: 4-acetyl-N-(4-chloro-3-nitrophenyl)-2,3-dihydro-1,4-benzothiazine-6-sulfonamide Traditional Name: 4-acetyl-N-(4-chloro-3-nitro-phenyl)-2,3-dihydro-1,4-benzothiazine-6-sulfonamide Formula: C16H14ClN3O5S2 MolecularWeight: 427.88246

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCSC2=C1C=C(C=C2)S(=O)(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCSC2=C1C=C(C=C2)S(=O)(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClN3O5S2/c1-10(21)19-6-7-26-16-5-3-12(9-15(16)19)27(24,25)18-11-2-4-13(17)14(8-11)20(22)23/h2-5,8-9,18H,6-7H2,1H3