2-[2-[methyl-[[5-(4-nitrophenyl)furan-2-yl]methyl]amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: 2-[2-[methyl-[[5-(4-nitrophenyl)furan-2-yl]methyl]amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: 2-[2-[methyl-[[5-(4-nitrophenyl)-2-furyl]methyl]amino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[methyl-[[5-(4-nitrophenyl)-2-furanyl]methyl]amino]-2-oxoethyl]thio]acetate IUPAC Name: 2-[2-[methyl-[[5-(4-nitrophenyl)furan-2-yl]methyl]amino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-[methyl-[[5-(4-nitrophenyl)-2-furyl]methyl]amino]ethyl]thio]acetate Formula: C16H15N2O6S- MolecularWeight: 363.3651

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CSCC(=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CSCC(=O)[O-]

InChI

InChI=1S/C16H16N2O6S/c1-17(15(19)9-25-10-16(20)21)8-13-6-7-14(24-13)11-2-4-12(5-3-11)18(22)23/h2-7H,8-10H2,1H3,(H,20,21)/p-1