[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-(4-nitrophenyl)sulfanylethanoate

Systemtic Name: [3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-(4-nitrophenyl)sulfanylethanoate Openeye Name: [3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-(4-nitrophenyl)sulfanylacetate CAS Name: 2-[(4-nitrophenyl)thio]acetic acid [3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-(4-nitrophenyl)sulfanylacetate Traditional Name: 2-[(4-nitrophenyl)thio]acetic acid [3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C18H15N3O6S MolecularWeight: 401.3932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NOC(=N2)COC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1C2=NOC(=N2)COC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O6S/c1-25-15-5-3-2-4-14(15)18-19-16(27-20-18)10-26-17(22)11-28-13-8-6-12(7-9-13)21(23)24/h2-9H,10-11H2,1H3