2-[4-[[5-butyl-3-(methoxymethyl)pyrazol-1-yl]methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[[5-butyl-3-(methoxymethyl)pyrazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[5-butyl-3-(methoxymethyl)pyrazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[5-butyl-3-(methoxymethyl)-1-pyrazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[5-butyl-3-(methoxymethyl)pyrazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[5-butyl-3-(methoxymethyl)pyrazol-1-yl]methyl]phenyl]benzoic acid Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=NN1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)COC

Isomeric SMILES

CCCCC1=CC(=NN1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)COC

InChI

InChI=1S/C23H26N2O3/c1-3-4-7-20-14-19(16-28-2)24-25(20)15-17-10-12-18(13-11-17)21-8-5-6-9-22(21)23(26)27/h5-6,8-14H,3-4,7,15-16H2,1-2H3,(H,26,27)