9-[3,5-diphenyl-4-(phenylmethyl)pyrazol-1-yl]nonanoic acid

Systemtic Name: 9-[3,5-diphenyl-4-(phenylmethyl)pyrazol-1-yl]nonanoic acid Openeye Name: 9-(4-benzyl-3,5-diphenyl-pyrazol-1-yl)nonanoic acid CAS Name: 9-[3,5-diphenyl-4-(phenylmethyl)-1-pyrazolyl]nonanoic acid IUPAC Name: 9-(4-benzyl-3,5-diphenylpyrazol-1-yl)nonanoic acid Traditional Name: 9-(4-benzyl-3,5-diphenyl-pyrazol-1-yl)pelargonic acid Formula: C31H34N2O2 MolecularWeight: 466.61386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(N(N=C2C3=CC=CC=C3)CCCCCCCCC(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(N(N=C2C3=CC=CC=C3)CCCCCCCCC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C31H34N2O2/c34-29(35)22-14-3-1-2-4-15-23-33-31(27-20-12-7-13-21-27)28(24-25-16-8-5-9-17-25)30(32-33)26-18-10-6-11-19-26/h5-13,16-21H,1-4,14-15,22-24H2,(H,34,35)