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

Systemtic Name: 2-[4-[[5-(methoxymethyl)-3-propyl-pyrazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[5-(methoxymethyl)-3-propyl-pyrazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[5-(methoxymethyl)-3-propyl-1-pyrazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[5-(methoxymethyl)-3-propylpyrazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[5-(methoxymethyl)-3-propyl-pyrazol-1-yl]methyl]phenyl]benzoic acid Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1)COC)CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CCCC1=NN(C(=C1)COC)CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C22H24N2O3/c1-3-6-18-13-19(15-27-2)24(23-18)14-16-9-11-17(12-10-16)20-7-4-5-8-21(20)22(25)26/h4-5,7-13H,3,6,14-15H2,1-2H3,(H,25,26)