11-(3,4,5-triphenylpyrazol-1-yl)undecanoic acid

Systemtic Name: 11-(3,4,5-triphenylpyrazol-1-yl)undecanoic acid Openeye Name: 11-(3,4,5-triphenylpyrazol-1-yl)undecanoic acid CAS Name: 11-(3,4,5-triphenyl-1-pyrazolyl)undecanoic acid IUPAC Name: 11-(3,4,5-triphenylpyrazol-1-yl)undecanoic acid Traditional Name: 11-(3,4,5-triphenylpyrazol-1-yl)undecanoic acid Formula: C32H36N2O2 MolecularWeight: 480.64044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(N=C2C3=CC=CC=C3)CCCCCCCCCCC(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(N=C2C3=CC=CC=C3)CCCCCCCCCCC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C32H36N2O2/c35-29(36)24-16-5-3-1-2-4-6-17-25-34-32(28-22-14-9-15-23-28)30(26-18-10-7-11-19-26)31(33-34)27-20-12-8-13-21-27/h7-15,18-23H,1-6,16-17,24-25H2,(H,35,36)