N-(2-methoxy-4-nitro-phenyl)-2-[2-[(2-methoxy-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)-2-[2-[(2-methoxy-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: 2-[2-(2-methoxy-4-nitro-anilino)-2-oxo-ethyl]sulfanyl-N-(2-methoxy-4-nitro-phenyl)acetamide CAS Name: 2-[[2-(2-methoxy-4-nitroanilino)-2-oxoethyl]thio]-N-(2-methoxy-4-nitrophenyl)acetamide IUPAC Name: 2-[2-(2-methoxy-4-nitroanilino)-2-oxoethyl]sulfanyl-N-(2-methoxy-4-nitrophenyl)acetamide Traditional Name: 2-[[2-keto-2-(2-methoxy-4-nitro-anilino)ethyl]thio]-N-(2-methoxy-4-nitro-phenyl)acetamide Formula: C18H18N4O8S MolecularWeight: 450.42252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C18H18N4O8S/c1-29-15-7-11(21(25)26)3-5-13(15)19-17(23)9-31-10-18(24)20-14-6-4-12(22(27)28)8-16(14)30-2/h3-8H,9-10H2,1-2H3,(H,19,23)(H,20,24)