methyl 4-[5-(6-methylpyridin-3-yl)-3-phenyl-3,4-dihydropyrazol-2-yl]benzoate

Systemtic Name: methyl 4-[5-(6-methylpyridin-3-yl)-3-phenyl-3,4-dihydropyrazol-2-yl]benzoate Openeye Name: methyl 4-[5-(6-methyl-3-pyridyl)-3-phenyl-3,4-dihydropyrazol-2-yl]benzoate CAS Name: 4-[5-(6-methyl-3-pyridinyl)-3-phenyl-3,4-dihydropyrazol-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-(6-methylpyridin-3-yl)-3-phenyl-3,4-dihydropyrazol-2-yl]benzoate Traditional Name: 4-[3-(6-methyl-3-pyridyl)-5-phenyl-2-pyrazolin-1-yl]benzoic acid methyl ester Formula: C23H21N3O2 MolecularWeight: 371.43174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C2=NN(C(C2)C3=CC=CC=C3)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=NC=C(C=C1)C2=NN(C(C2)C3=CC=CC=C3)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C23H21N3O2/c1-16-8-9-19(15-24-16)21-14-22(17-6-4-3-5-7-17)26(25-21)20-12-10-18(11-13-20)23(27)28-2/h3-13,15,22H,14H2,1-2H3