ethyl 2-[(2R)-1-[(2-methoxy-4-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[(2R)-1-[(2-methoxy-4-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[(1R)-2-(2-methoxy-4-nitro-anilino)-1-methyl-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[(2R)-1-(2-methoxy-4-nitroanilino)-1-oxopropan-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2R)-1-(2-methoxy-4-nitroanilino)-1-oxopropan-2-yl]sulfanylacetate Traditional Name: 2-[[(1R)-2-keto-2-(2-methoxy-4-nitro-anilino)-1-methyl-ethyl]thio]acetic acid ethyl ester Formula: C14H18N2O6S MolecularWeight: 342.36752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O6S/c1-4-22-13(17)8-23-9(2)14(18)15-11-6-5-10(16(19)20)7-12(11)21-3/h5-7,9H,4,8H2,1-3H3,(H,15,18)/t9-/m1/s1