[2-(4-ethylphenyl)-2-oxidanylidene-ethyl] 3-(4-nitrophenyl)sulfanylpropanoate

Systemtic Name: [2-(4-ethylphenyl)-2-oxidanylidene-ethyl] 3-(4-nitrophenyl)sulfanylpropanoate Openeye Name: [2-(4-ethylphenyl)-2-oxo-ethyl] 3-(4-nitrophenyl)sulfanylpropanoate CAS Name: 3-[(4-nitrophenyl)thio]propanoic acid [2-(4-ethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-ethylphenyl)-2-oxoethyl] 3-(4-nitrophenyl)sulfanylpropanoate Traditional Name: 3-[(4-nitrophenyl)thio]propionic acid [2-(4-ethylphenyl)-2-keto-ethyl] ester Formula: C19H19NO5S MolecularWeight: 373.42286

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)COC(=O)CCSC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)COC(=O)CCSC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H19NO5S/c1-2-14-3-5-15(6-4-14)18(21)13-25-19(22)11-12-26-17-9-7-16(8-10-17)20(23)24/h3-10H,2,11-13H2,1H3