[5-(4-chlorophenyl)-1,3-oxazol-2-yl]methyl 2-(4-nitrophenyl)sulfanylethanoate

Systemtic Name: [5-(4-chlorophenyl)-1,3-oxazol-2-yl]methyl 2-(4-nitrophenyl)sulfanylethanoate Openeye Name: [5-(4-chlorophenyl)oxazol-2-yl]methyl 2-(4-nitrophenyl)sulfanylacetate CAS Name: 2-[(4-nitrophenyl)thio]acetic acid [5-(4-chlorophenyl)-2-oxazolyl]methyl ester IUPAC Name: [5-(4-chlorophenyl)-1,3-oxazol-2-yl]methyl 2-(4-nitrophenyl)sulfanylacetate Traditional Name: 2-[(4-nitrophenyl)thio]acetic acid [5-(4-chlorophenyl)oxazol-2-yl]methyl ester Formula: C18H13ClN2O5S MolecularWeight: 404.82422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CN=C(O2)COC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C2=CN=C(O2)COC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H13ClN2O5S/c19-13-3-1-12(2-4-13)16-9-20-17(26-16)10-25-18(22)11-27-15-7-5-14(6-8-15)21(23)24/h1-9H,10-11H2