(E)-4-(2-methoxyphenyl)-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)but-3-enoic acid

Systemtic Name: (E)-4-(2-methoxyphenyl)-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)but-3-enoic acid Openeye Name: (E)-4-(2-methoxyphenyl)-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]but-3-enoic acid CAS Name: (E)-4-(2-methoxyphenyl)-3-[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]-3-butenoic acid IUPAC Name: (E)-4-(2-methoxyphenyl)-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)but-3-enoic acid Traditional Name: (E)-4-(2-methoxyphenyl)-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]but-3-enoic acid Formula: C17H14N2O4S MolecularWeight: 342.36906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=C(CC(=O)O)C2=NC(=NO2)C3=CSC=C3

Isomeric SMILES

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

InChI

InChI=1S/C17H14N2O4S/c1-22-14-5-3-2-4-11(14)8-13(9-15(20)21)17-18-16(19-23-17)12-6-7-24-10-12/h2-8,10H,9H2,1H3,(H,20,21)/b13-8+