3-(1-phenylpyrazol-4-yl)propanoic acid

Systemtic Name: 3-(1-phenylpyrazol-4-yl)propanoic acid Openeye Name: 3-(1-phenylpyrazol-4-yl)propanoic acid CAS Name: 3-(1-phenyl-4-pyrazolyl)propanoic acid IUPAC Name: 3-(1-phenylpyrazol-4-yl)propanoic acid Traditional Name: 3-(1-phenylpyrazol-4-yl)propionic acid Formula: C12H12N2O2 MolecularWeight: 216.23588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O2/c15-12(16)7-6-10-8-13-14(9-10)11-4-2-1-3-5-11/h1-5,8-9H,6-7H2,(H,15,16)