(E)-4-(4-methoxy-3-oxidanyl-phenyl)-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)but-3-enoate

Systemtic Name: (E)-4-(4-methoxy-3-oxidanyl-phenyl)-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)but-3-enoate Openeye Name: (E)-4-(3-hydroxy-4-methoxy-phenyl)-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]but-3-enoate CAS Name: (E)-4-(3-hydroxy-4-methoxyphenyl)-3-[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]-3-butenoate IUPAC Name: (E)-4-(3-hydroxy-4-methoxyphenyl)-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)but-3-enoate Traditional Name: (E)-4-(3-hydroxy-4-methoxy-phenyl)-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]but-3-enoate Formula: C17H13N2O5S- MolecularWeight: 357.36052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C(CC(=O)[O-])C2=NC(=NO2)C3=CSC=C3)O

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C(\CC(=O)[O-])/C2=NC(=NO2)C3=CSC=C3)O

InChI

InChI=1S/C17H14N2O5S/c1-23-14-3-2-10(7-13(14)20)6-12(8-15(21)22)17-18-16(19-24-17)11-4-5-25-9-11/h2-7,9,20H,8H2,1H3,(H,21,22)/p-1/b12-6+