(E)-3-[1,3-dimethyl-5-(1,2,4-triazol-1-yl)pyrazol-4-yl]prop-2-enoate

Systemtic Name: (E)-3-[1,3-dimethyl-5-(1,2,4-triazol-1-yl)pyrazol-4-yl]prop-2-enoate Openeye Name: (E)-3-[1,3-dimethyl-5-(1,2,4-triazol-1-yl)pyrazol-4-yl]prop-2-enoate CAS Name: (E)-3-[1,3-dimethyl-5-(1,2,4-triazol-1-yl)-4-pyrazolyl]-2-propenoate IUPAC Name: (E)-3-[1,3-dimethyl-5-(1,2,4-triazol-1-yl)pyrazol-4-yl]prop-2-enoate Traditional Name: (E)-3-[1,3-dimethyl-5-(1,2,4-triazol-1-yl)pyrazol-4-yl]acrylate Formula: C10H10N5O2- MolecularWeight: 232.2187

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)[O-])N2C=NC=N2)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)[O-])N2C=NC=N2)C

InChI

InChI=1S/C10H11N5O2/c1-7-8(3-4-9(16)17)10(14(2)13-7)15-6-11-5-12-15/h3-6H,1-2H3,(H,16,17)/p-1/b4-3+