N-[2-[(4-methyl-3-sulfamoyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[(4-methyl-3-sulfamoyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-(4-methyl-3-sulfamoyl-anilino)-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-keto-2-(4-methyl-3-sulfamoyl-anilino)ethyl]-3-nitro-benzamide Formula: C16H16N4O6S MolecularWeight: 392.38644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C16H16N4O6S/c1-10-5-6-12(8-14(10)27(17,25)26)19-15(21)9-18-16(22)11-3-2-4-13(7-11)20(23)24/h2-8H,9H2,1H3,(H,18,22)(H,19,21)(H2,17,25,26)