(4-nitrophenyl)methyl 2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: (4-nitrophenyl)methyl 2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: (4-nitrophenyl)methyl 2-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]acetic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]acetic acid (4-nitrobenzyl) ester Formula: C18H17NO6S MolecularWeight: 375.39568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSCC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSCC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H17NO6S/c1-24-16-8-4-14(5-9-16)17(20)11-26-12-18(21)25-10-13-2-6-15(7-3-13)19(22)23/h2-9H,10-12H2,1H3