methyl (E)-3-[4-(1,2,4-triazol-1-yl)phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[4-(1,2,4-triazol-1-yl)phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[4-(1,2,4-triazol-1-yl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(1,2,4-triazol-1-yl)phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-(1,2,4-triazol-1-yl)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(1,2,4-triazol-1-yl)phenyl]acrylic acid methyl ester Formula: C12H11N3O2 MolecularWeight: 229.23464

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC=C(C=C1)N2C=NC=N2

Isomeric SMILES

COC(=O)/C=C/C1=CC=C(C=C1)N2C=NC=N2

InChI

InChI=1S/C12H11N3O2/c1-17-12(16)7-4-10-2-5-11(6-3-10)15-9-13-8-14-15/h2-9H,1H3/b7-4+