dipropan-2-yl 4-[3-(4-ethoxy-3-fluoranyl-phenyl)-1-phenyl-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dipropan-2-yl 4-[3-(4-ethoxy-3-fluoranyl-phenyl)-1-phenyl-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diisopropyl 4-[3-(4-ethoxy-3-fluoro-phenyl)-1-phenyl-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-[3-(4-ethoxy-3-fluorophenyl)-1-phenyl-4-pyrazolyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 4-[3-(4-ethoxy-3-fluorophenyl)-1-phenylpyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-[3-(4-ethoxy-3-fluoro-phenyl)-1-phenyl-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diisopropyl ester Formula: C32H36FN3O5 MolecularWeight: 561.643743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NN(C=C2C3C(=C(NC(=C3C(=O)OC(C)C)C)C)C(=O)OC(C)C)C4=CC=CC=C4)F

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NN(C=C2C3C(=C(NC(=C3C(=O)OC(C)C)C)C)C(=O)OC(C)C)C4=CC=CC=C4)F

InChI

InChI=1S/C32H36FN3O5/c1-8-39-26-15-14-22(16-25(26)33)30-24(17-36(35-30)23-12-10-9-11-13-23)29-27(31(37)40-18(2)3)20(6)34-21(7)28(29)32(38)41-19(4)5/h9-19,29,34H,8H2,1-7H3