6-[(3R)-2,5-diphenyl-3,4-dihydropyrazol-3-yl]-2,3-dimethoxy-benzoic acid

Systemtic Name: 6-[(3R)-2,5-diphenyl-3,4-dihydropyrazol-3-yl]-2,3-dimethoxy-benzoic acid Openeye Name: 6-[(3R)-2,5-diphenyl-3,4-dihydropyrazol-3-yl]-2,3-dimethoxy-benzoic acid CAS Name: 6-[(3R)-2,5-diphenyl-3,4-dihydropyrazol-3-yl]-2,3-dimethoxybenzoic acid IUPAC Name: 6-[(3R)-2,5-diphenyl-3,4-dihydropyrazol-3-yl]-2,3-dimethoxybenzoic acid Traditional Name: 6-[(3R)-2,5-diphenyl-2-pyrazolin-3-yl]-2,3-dimethoxy-benzoic acid Formula: C24H22N2O4 MolecularWeight: 402.44248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)[C@H]2CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O)OC

InChI

InChI=1S/C24H22N2O4/c1-29-21-14-13-18(22(24(27)28)23(21)30-2)20-15-19(16-9-5-3-6-10-16)25-26(20)17-11-7-4-8-12-17/h3-14,20H,15H2,1-2H3,(H,27,28)/t20-/m1/s1