1-[(3-phenoxyphenyl)methyl]-3-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-[(3-phenoxyphenyl)methyl]-3-phenyl-pyrazole-4-carboxylic acid Openeye Name: 1-[(3-phenoxyphenyl)methyl]-3-phenyl-pyrazole-4-carboxylic acid CAS Name: 1-[(3-phenoxyphenyl)methyl]-3-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 1-[(3-phenoxyphenyl)methyl]-3-phenylpyrazole-4-carboxylic acid Traditional Name: 1-(3-phenoxybenzyl)-3-phenyl-pyrazole-4-carboxylic acid Formula: C23H18N2O3 MolecularWeight: 370.40062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C(=O)O)CC3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2C(=O)O)CC3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C23H18N2O3/c26-23(27)21-16-25(24-22(21)18-9-3-1-4-10-18)15-17-8-7-13-20(14-17)28-19-11-5-2-6-12-19/h1-14,16H,15H2,(H,26,27)