methyl (E)-4-(1,2,4-triazol-1-yl)but-2-enoate

Systemtic Name: methyl (E)-4-(1,2,4-triazol-1-yl)but-2-enoate Openeye Name: methyl (E)-4-(1,2,4-triazol-1-yl)but-2-enoate CAS Name: (E)-4-(1,2,4-triazol-1-yl)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-(1,2,4-triazol-1-yl)but-2-enoate Traditional Name: (E)-4-(1,2,4-triazol-1-yl)but-2-enoic acid methyl ester Formula: C7H9N3O2 MolecularWeight: 167.16526

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CCN1C=NC=N1

Isomeric SMILES

COC(=O)/C=C/CN1C=NC=N1

InChI

InChI=1S/C7H9N3O2/c1-12-7(11)3-2-4-10-6-8-5-9-10/h2-3,5-6H,4H2,1H3/b3-2+