(phenylmethyl) 3-(aminomethyl)-5-(4-fluorophenyl)-4-pyridin-4-yl-pyrazole-1-carboxylate

Systemtic Name: (phenylmethyl) 3-(aminomethyl)-5-(4-fluorophenyl)-4-pyridin-4-yl-pyrazole-1-carboxylate Openeye Name: benzyl 3-(aminomethyl)-5-(4-fluorophenyl)-4-(4-pyridyl)pyrazole-1-carboxylate CAS Name: 3-(aminomethyl)-5-(4-fluorophenyl)-4-pyridin-4-yl-1-pyrazolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(aminomethyl)-5-(4-fluorophenyl)-4-pyridin-4-ylpyrazole-1-carboxylate Traditional Name: 3-(aminomethyl)-5-(4-fluorophenyl)-4-(4-pyridyl)pyrazole-1-carboxylic acid benzyl ester Formula: C23H19FN4O2 MolecularWeight: 402.420963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N2C(=C(C(=N2)CN)C3=CC=NC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N2C(=C(C(=N2)CN)C3=CC=NC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H19FN4O2/c24-19-8-6-18(7-9-19)22-21(17-10-12-26-13-11-17)20(14-25)27-28(22)23(29)30-15-16-4-2-1-3-5-16/h1-13H,14-15,25H2