(E)-4-[2-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[2-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[2-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[2-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[2-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-[2-(3-methyl-1,2,4-oxadiazol-5-yl)phenoxy]but-2-enoic acid Formula: C13H10N2O5 MolecularWeight: 274.2289

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)C2=CC=CC=C2OC(=O)C=CC(=O)O

Isomeric SMILES

CC1=NOC(=N1)C2=CC=CC=C2OC(=O)/C=C/C(=O)O

InChI

InChI=1S/C13H10N2O5/c1-8-14-13(20-15-8)9-4-2-3-5-10(9)19-12(18)7-6-11(16)17/h2-7H,1H3,(H,16,17)/b7-6+