(4-nitrophenyl)methyl 3-ethylsulfanyl-3-oxidanylidene-propanoate

Systemtic Name: (4-nitrophenyl)methyl 3-ethylsulfanyl-3-oxidanylidene-propanoate Openeye Name: (4-nitrophenyl)methyl 3-ethylsulfanyl-3-oxo-propanoate CAS Name: 3-(ethylthio)-3-oxopropanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-ethylsulfanyl-3-oxopropanoate Traditional Name: 3-(ethylthio)-3-keto-propionic acid (4-nitrobenzyl) ester Formula: C12H13NO5S MolecularWeight: 283.30032

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)CC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCSC(=O)CC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H13NO5S/c1-2-19-12(15)7-11(14)18-8-9-3-5-10(6-4-9)13(16)17/h3-6H,2,7-8H2,1H3