3-(4,5-dimethyl-2-phenylmethoxy-phenyl)-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-(4,5-dimethyl-2-phenylmethoxy-phenyl)-1H-pyrazole-5-carboxylic acid Openeye Name: 3-(2-benzyloxy-4,5-dimethyl-phenyl)-1H-pyrazole-5-carboxylic acid CAS Name: 3-(4,5-dimethyl-2-phenylmethoxyphenyl)-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-(4,5-dimethyl-2-phenylmethoxyphenyl)-1H-pyrazole-5-carboxylic acid Traditional Name: 3-(2-benzoxy-4,5-dimethyl-phenyl)-1H-pyrazole-5-carboxylic acid Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C2=NNC(=C2)C(=O)O)OCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C(=C1)C2=NNC(=C2)C(=O)O)OCC3=CC=CC=C3)C

InChI

InChI=1S/C19H18N2O3/c1-12-8-15(16-10-17(19(22)23)21-20-16)18(9-13(12)2)24-11-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,20,21)(H,22,23)