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

Systemtic Name: N-methyl-2-(2-methyl-5-nitro-3-oxidanylidene-1,2-benzothiazol-1-ium-1-yl)benzamide Openeye Name: N-methyl-2-(2-methyl-5-nitro-3-oxo-1,2-benzothiazol-1-ium-1-yl)benzamide CAS Name: N-methyl-2-(2-methyl-5-nitro-3-oxo-1,2-benzothiazol-1-ium-1-yl)benzamide IUPAC Name: N-methyl-2-(2-methyl-5-nitro-3-oxo-1,2-benzothiazol-1-ium-1-yl)benzamide Traditional Name: 2-(3-keto-2-methyl-5-nitro-1,2-benzothiazol-1-ium-1-yl)-N-methyl-benzamide Formula: C16H14N3O4S+ MolecularWeight: 344.36506

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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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N3O4S/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/p+1