[(5R)-5-methyl-2-phenyl-1,5-dihydropyrazol-3-yl] 2-chloranylpyridine-3-carboxylate

Systemtic Name: [(5R)-5-methyl-2-phenyl-1,5-dihydropyrazol-3-yl] 2-chloranylpyridine-3-carboxylate Openeye Name: [(5R)-5-methyl-2-phenyl-1,5-dihydropyrazol-3-yl] 2-chloropyridine-3-carboxylate CAS Name: 2-chloro-3-pyridinecarboxylic acid [(5R)-5-methyl-2-phenyl-1,5-dihydropyrazol-3-yl] ester IUPAC Name: [(5R)-5-methyl-2-phenyl-1,5-dihydropyrazol-3-yl] 2-chloropyridine-3-carboxylate Traditional Name: 2-chloronicotinic acid [(5R)-5-methyl-2-phenyl-3-pyrazolin-3-yl] ester Formula: C16H14ClN3O2 MolecularWeight: 315.75426

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(N(N1)C2=CC=CC=C2)OC(=O)C3=C(N=CC=C3)Cl

Isomeric SMILES

C[C@@H]1C=C(N(N1)C2=CC=CC=C2)OC(=O)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C16H14ClN3O2/c1-11-10-14(20(19-11)12-6-3-2-4-7-12)22-16(21)13-8-5-9-18-15(13)17/h2-11,19H,1H3/t11-/m1/s1