ethyl 2-[2-[(2-methoxy-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfonylethanoate

Systemtic Name: ethyl 2-[2-[(2-methoxy-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfonylethanoate Openeye Name: ethyl 2-[2-(2-methoxy-4-nitro-anilino)-2-oxo-ethyl]sulfonylacetate CAS Name: 2-[2-(2-methoxy-4-nitroanilino)-2-oxoethyl]sulfonylacetic acid ethyl ester IUPAC Name: ethyl 2-[2-(2-methoxy-4-nitroanilino)-2-oxoethyl]sulfonylacetate Traditional Name: 2-[2-keto-2-(2-methoxy-4-nitro-anilino)ethyl]sulfonylacetic acid ethyl ester Formula: C13H16N2O8S MolecularWeight: 360.33974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)CC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC

Isomeric SMILES

CCOC(=O)CS(=O)(=O)CC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC

InChI

InChI=1S/C13H16N2O8S/c1-3-23-13(17)8-24(20,21)7-12(16)14-10-5-4-9(15(18)19)6-11(10)22-2/h4-6H,3,7-8H2,1-2H3,(H,14,16)