ethyl 2-[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-(3-nitroanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(3-nitroanilino)-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(3-nitroanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-(3-nitroanilino)ethyl]thio]acetic acid ethyl ester Formula: C12H14N2O5S MolecularWeight: 298.31496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)NC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CSCC(=O)NC1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O5S/c1-2-19-12(16)8-20-7-11(15)13-9-4-3-5-10(6-9)14(17)18/h3-6H,2,7-8H2,1H3,(H,13,15)