1-(6-methoxypyridin-3-yl)-5-(4-phenylmethoxyphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 1-(6-methoxypyridin-3-yl)-5-(4-phenylmethoxyphenyl)pyrazole-3-carboxylic acid Openeye Name: 5-(4-benzyloxyphenyl)-1-(6-methoxy-3-pyridyl)pyrazole-3-carboxylic acid CAS Name: 1-(6-methoxy-3-pyridinyl)-5-(4-phenylmethoxyphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-(6-methoxypyridin-3-yl)-5-(4-phenylmethoxyphenyl)pyrazole-3-carboxylic acid Traditional Name: 5-(4-benzoxyphenyl)-1-(6-methoxy-3-pyridyl)pyrazole-3-carboxylic acid Formula: C23H19N3O4 MolecularWeight: 401.41466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)N2C(=CC(=N2)C(=O)O)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=NC=C(C=C1)N2C(=CC(=N2)C(=O)O)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H19N3O4/c1-29-22-12-9-18(14-24-22)26-21(13-20(25-26)23(27)28)17-7-10-19(11-8-17)30-15-16-5-3-2-4-6-16/h2-14H,15H2,1H3,(H,27,28)