4-(1-pentylpyrazol-4-yl)benzoic acid

Systemtic Name: 4-(1-pentylpyrazol-4-yl)benzoic acid Openeye Name: 4-(1-pentylpyrazol-4-yl)benzoic acid CAS Name: 4-(1-pentyl-4-pyrazolyl)benzoic acid IUPAC Name: 4-(1-pentylpyrazol-4-yl)benzoic acid Traditional Name: 4-(1-amylpyrazol-4-yl)benzoic acid Formula: C15H18N2O2 MolecularWeight: 258.31562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=C(C=N1)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCCCCN1C=C(C=N1)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C15H18N2O2/c1-2-3-4-9-17-11-14(10-16-17)12-5-7-13(8-6-12)15(18)19/h5-8,10-11H,2-4,9H2,1H3,(H,18,19)