(E)-3-(5-ethyl-1-methyl-pyrazol-4-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(5-ethyl-1-methyl-pyrazol-4-yl)prop-2-enoic acid Openeye Name: (E)-3-(5-ethyl-1-methyl-pyrazol-4-yl)prop-2-enoic acid CAS Name: (E)-3-(5-ethyl-1-methyl-4-pyrazolyl)-2-propenoic acid IUPAC Name: (E)-3-(5-ethyl-1-methylpyrazol-4-yl)prop-2-enoic acid Traditional Name: (E)-3-(5-ethyl-1-methyl-pyrazol-4-yl)acrylic acid Formula: C9H12N2O2 MolecularWeight: 180.20378

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C)C=CC(=O)O

Isomeric SMILES

CCC1=C(C=NN1C)/C=C/C(=O)O

InChI

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