N-methyl-2-(2-methyl-5-nitro-3-oxidanylidene-1,2-benzothiazol-1-ium-1-yl)benzamide chloride

Systemtic Name: N-methyl-2-(2-methyl-5-nitro-3-oxidanylidene-1,2-benzothiazol-1-ium-1-yl)benzamide chloride Openeye Name: N-methyl-2-(2-methyl-5-nitro-3-oxo-1,2-benzothiazol-1-ium-1-yl)benzamide chloride CAS Name: N-methyl-2-(2-methyl-5-nitro-3-oxo-1,2-benzothiazol-1-ium-1-yl)benzamide chloride IUPAC Name: N-methyl-2-(2-methyl-5-nitro-3-oxo-1,2-benzothiazol-1-ium-1-yl)benzamide chloride Traditional Name: 2-(3-keto-2-methyl-5-nitro-1,2-benzothiazol-1-ium-1-yl)-N-methyl-benzamide chloride Formula: C16H14ClN3O4S MolecularWeight: 379.81806

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=CC=C1[S+]2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2C.[Cl-]

Isomeric SMILES

CNC(=O)C1=CC=CC=C1[S+]2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2C.[Cl-]

InChI

InChI=1S/C16H13N3O4S.ClH/c1-17-15(20)11-5-3-4-6-13(11)24-14-8-7-10(19(22)23)9-12(14)16(21)18(24)2;/h3-9H,1-2H3;1H