(E)-5-(1-phenylpyrazol-4-yl)pent-2-enoic acid

Systemtic Name: (E)-5-(1-phenylpyrazol-4-yl)pent-2-enoic acid Openeye Name: (E)-5-(1-phenylpyrazol-4-yl)pent-2-enoic acid CAS Name: (E)-5-(1-phenyl-4-pyrazolyl)-2-pentenoic acid IUPAC Name: (E)-5-(1-phenylpyrazol-4-yl)pent-2-enoic acid Traditional Name: (E)-5-(1-phenylpyrazol-4-yl)pent-2-enoic acid Formula: C14H14N2O2 MolecularWeight: 242.27316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CCC=CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CC/C=C/C(=O)O

InChI

InChI=1S/C14H14N2O2/c17-14(18)9-5-4-6-12-10-15-16(11-12)13-7-2-1-3-8-13/h1-3,5,7-11H,4,6H2,(H,17,18)/b9-5+