(E)-3-(3,5-dimethyl-1-propyl-pyrazol-4-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(3,5-dimethyl-1-propyl-pyrazol-4-yl)prop-2-enoic acid Openeye Name: (E)-3-(3,5-dimethyl-1-propyl-pyrazol-4-yl)prop-2-enoic acid CAS Name: (E)-3-(3,5-dimethyl-1-propyl-4-pyrazolyl)-2-propenoic acid IUPAC Name: (E)-3-(3,5-dimethyl-1-propylpyrazol-4-yl)prop-2-enoic acid Traditional Name: (E)-3-(3,5-dimethyl-1-propyl-pyrazol-4-yl)acrylic acid Formula: C11H16N2O2 MolecularWeight: 208.25694

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=N1)C)C=CC(=O)O)C

Isomeric SMILES

CCCN1C(=C(C(=N1)C)/C=C/C(=O)O)C

InChI

InChI=1S/C11H16N2O2/c1-4-7-13-9(3)10(8(2)12-13)5-6-11(14)15/h5-6H,4,7H2,1-3H3,(H,14,15)/b6-5+