3-(4-methoxyphenyl)-1-(phenylmethyl)pyrazole-4-carboxylic acid

Systemtic Name: 3-(4-methoxyphenyl)-1-(phenylmethyl)pyrazole-4-carboxylic acid Openeye Name: 1-benzyl-3-(4-methoxyphenyl)pyrazole-4-carboxylic acid CAS Name: 3-(4-methoxyphenyl)-1-(phenylmethyl)-4-pyrazolecarboxylic acid IUPAC Name: 1-benzyl-3-(4-methoxyphenyl)pyrazole-4-carboxylic acid Traditional Name: 1-benzyl-3-(4-methoxyphenyl)pyrazole-4-carboxylic acid Formula: C18H16N2O3 MolecularWeight: 308.33124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C(=O)O)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2C(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C18H16N2O3/c1-23-15-9-7-14(8-10-15)17-16(18(21)22)12-20(19-17)11-13-5-3-2-4-6-13/h2-10,12H,11H2,1H3,(H,21,22)