(2-methoxy-5-nitro-phenyl)methyl 3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate

Systemtic Name: (2-methoxy-5-nitro-phenyl)methyl 3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate Openeye Name: (2-methoxy-5-nitro-phenyl)methyl 3-[2-oxo-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propanoate CAS Name: 3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoic acid (2-methoxy-5-nitrophenyl)methyl ester IUPAC Name: (2-methoxy-5-nitrophenyl)methyl 3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate Traditional Name: 3-[2-keto-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propionic acid (2-methoxy-5-nitro-benzyl) ester Formula: C17H15N3O7S MolecularWeight: 405.3819

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])COC(=O)CCN2C(=O)OC(=N2)C3=CC=CS3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])COC(=O)CCN2C(=O)OC(=N2)C3=CC=CS3

InChI

InChI=1S/C17H15N3O7S/c1-25-13-5-4-12(20(23)24)9-11(13)10-26-15(21)6-7-19-17(22)27-16(18-19)14-3-2-8-28-14/h2-5,8-9H,6-7,10H2,1H3