(E)-3-(1-ethyl-3-methyl-pyrazol-4-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(1-ethyl-3-methyl-pyrazol-4-yl)prop-2-enoic acid Openeye Name: (E)-3-(1-ethyl-3-methyl-pyrazol-4-yl)prop-2-enoic acid CAS Name: (E)-3-(1-ethyl-3-methyl-4-pyrazolyl)-2-propenoic acid IUPAC Name: (E)-3-(1-ethyl-3-methylpyrazol-4-yl)prop-2-enoic acid Traditional Name: (E)-3-(1-ethyl-3-methyl-pyrazol-4-yl)acrylic acid Formula: C9H12N2O2 MolecularWeight: 180.20378

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C=CC(=O)O

Isomeric SMILES

CCN1C=C(C(=N1)C)/C=C/C(=O)O

InChI

InChI=1S/C9H12N2O2/c1-3-11-6-8(7(2)10-11)4-5-9(12)13/h4-6H,3H2,1-2H3,(H,12,13)/b5-4+