(E)-3-(1-propan-2-ylpyrazol-4-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(1-propan-2-ylpyrazol-4-yl)prop-2-enoic acid Openeye Name: (E)-3-(1-isopropylpyrazol-4-yl)prop-2-enoic acid CAS Name: (E)-3-(1-propan-2-yl-4-pyrazolyl)-2-propenoic acid IUPAC Name: (E)-3-(1-propan-2-ylpyrazol-4-yl)prop-2-enoic acid Traditional Name: (E)-3-(1-isopropylpyrazol-4-yl)acrylic acid Formula: C9H12N2O2 MolecularWeight: 180.20378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C=N1)C=CC(=O)O

Isomeric SMILES

CC(C)N1C=C(C=N1)/C=C/C(=O)O

InChI

InChI=1S/C9H12N2O2/c1-7(2)11-6-8(5-10-11)3-4-9(12)13/h3-7H,1-2H3,(H,12,13)/b4-3+