8-(4,5-diphenylpyrazol-1-yl)octanoic acid

Systemtic Name: 8-(4,5-diphenylpyrazol-1-yl)octanoic acid Openeye Name: 8-(4,5-diphenylpyrazol-1-yl)octanoic acid CAS Name: 8-(4,5-diphenyl-1-pyrazolyl)octanoic acid IUPAC Name: 8-(4,5-diphenylpyrazol-1-yl)octanoic acid Traditional Name: 8-(4,5-diphenylpyrazol-1-yl)caprylic acid Formula: C23H26N2O2 MolecularWeight: 362.46474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(N=C2)CCCCCCCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(N=C2)CCCCCCCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C23H26N2O2/c26-22(27)16-10-2-1-3-11-17-25-23(20-14-8-5-9-15-20)21(18-24-25)19-12-6-4-7-13-19/h4-9,12-15,18H,1-3,10-11,16-17H2,(H,26,27)