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

Systemtic Name: (E)-4-(3-ethoxy-2-methoxy-phenyl)-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)but-3-enoic acid Openeye Name: (E)-4-(3-ethoxy-2-methoxy-phenyl)-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]but-3-enoic acid CAS Name: (E)-4-(3-ethoxy-2-methoxyphenyl)-3-[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]-3-butenoic acid IUPAC Name: (E)-4-(3-ethoxy-2-methoxyphenyl)-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)but-3-enoic acid Traditional Name: (E)-4-(3-ethoxy-2-methoxy-phenyl)-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]but-3-enoic acid Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1OC)C=C(CC(=O)O)C2=NC(=NO2)C3=CSC=C3

Isomeric SMILES

CCOC1=CC=CC(=C1OC)/C=C(\CC(=O)O)/C2=NC(=NO2)C3=CSC=C3

InChI

InChI=1S/C19H18N2O5S/c1-3-25-15-6-4-5-12(17(15)24-2)9-14(10-16(22)23)19-20-18(21-26-19)13-7-8-27-11-13/h4-9,11H,3,10H2,1-2H3,(H,22,23)/b14-9+