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9-(3,4,5-triphenylpyrazol-1-yl)nonanoic acid

9-(3,4,5-triphenylpyrazol-1-yl)nonanoic acid

Systemtic Name:9-(3,4,5-triphenylpyrazol-1-yl)nonanoic acid
Openeye Name:9-(3,4,5-triphenylpyrazol-1-yl)nonanoic acid
CAS Name:9-(3,4,5-triphenyl-1-pyrazolyl)nonanoic acid
IUPAC Name:9-(3,4,5-triphenylpyrazol-1-yl)nonanoic acid
Traditional Name:9-(3,4,5-triphenylpyrazol-1-yl)pelargonic acid
Formula: C30H32N2O2
MolecularWeight: 452.58728
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C30H32N2O2/c33-27(34)22-14-3-1-2-4-15-23-32-30(26-20-12-7-13-21-26)28(24-16-8-5-9-17-24)29(31-32)25-18-10-6-11-19-25/h5-13,16-21H,1-4,14-15,22-23H2,(H,33,34)


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