ethyl 2-[2-(2-methoxy-2-oxidanylidene-ethyl)-5-nitro-phenyl]-2-phenylsulfanyl-ethanoate

Systemtic Name: ethyl 2-[2-(2-methoxy-2-oxidanylidene-ethyl)-5-nitro-phenyl]-2-phenylsulfanyl-ethanoate Openeye Name: ethyl 2-[2-(2-methoxy-2-oxo-ethyl)-5-nitro-phenyl]-2-phenylsulfanyl-acetate CAS Name: 2-[2-(2-methoxy-2-oxoethyl)-5-nitrophenyl]-2-(phenylthio)acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(2-methoxy-2-oxoethyl)-5-nitrophenyl]-2-phenylsulfanylacetate Traditional Name: 2-[2-(2-keto-2-methoxy-ethyl)-5-nitro-phenyl]-2-(phenylthio)acetic acid ethyl ester Formula: C19H19NO6S MolecularWeight: 389.42226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(C=CC(=C1)[N+](=O)[O-])CC(=O)OC)SC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C1=C(C=CC(=C1)[N+](=O)[O-])CC(=O)OC)SC2=CC=CC=C2

InChI

InChI=1S/C19H19NO6S/c1-3-26-19(22)18(27-15-7-5-4-6-8-15)16-12-14(20(23)24)10-9-13(16)11-17(21)25-2/h4-10,12,18H,3,11H2,1-2H3