4-[2-[(4-fluoranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide

Systemtic Name: 4-[2-[(4-fluoranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide Openeye Name: 4-[2-(4-fluoro-3-nitro-anilino)-2-oxo-ethyl]sulfanyl-3-nitro-benzamide CAS Name: 4-[[2-(4-fluoro-3-nitroanilino)-2-oxoethyl]thio]-3-nitrobenzamide IUPAC Name: 4-[2-(4-fluoro-3-nitroanilino)-2-oxoethyl]sulfanyl-3-nitrobenzamide Traditional Name: 4-[[2-(4-fluoro-3-nitro-anilino)-2-keto-ethyl]thio]-3-nitro-benzamide Formula: C15H11FN4O6S MolecularWeight: 394.334443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])SCC(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])SCC(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C15H11FN4O6S/c16-10-3-2-9(6-11(10)19(23)24)18-14(21)7-27-13-4-1-8(15(17)22)5-12(13)20(25)26/h1-6H,7H2,(H2,17,22)(H,18,21)