(1,3-diphenylpyrazol-4-yl)methyl pyridine-3-carboxylate

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl pyridine-3-carboxylate Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid (1,3-diphenyl-4-pyrazolyl)methyl ester IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl pyridine-3-carboxylate Traditional Name: nicotinic acid (1,3-diphenylpyrazol-4-yl)methyl ester Formula: C22H17N3O2 MolecularWeight: 355.38928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2COC(=O)C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2COC(=O)C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O2/c26-22(18-10-7-13-23-14-18)27-16-19-15-25(20-11-5-2-6-12-20)24-21(19)17-8-3-1-4-9-17/h1-15H,16H2