bis(2-methylpropyl) 2,6-dimethyl-4-[3-(2-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: bis(2-methylpropyl) 2,6-dimethyl-4-[3-(2-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diisobutyl 2,6-dimethyl-4-[3-(2-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-[3-(2-methyl-4-propoxyphenyl)-1-phenyl-4-pyrazolyl]-1,4-dihydropyridine-3,5-dicarboxylic acid bis(2-methylpropyl) ester IUPAC Name: bis(2-methylpropyl) 2,6-dimethyl-4-[3-(2-methyl-4-propoxyphenyl)-1-phenylpyrazol-4-yl]-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-[3-(2-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]-1,4-dihydropyridine-3,5-dicarboxylic acid diisobutyl ester Formula: C36H45N3O5 MolecularWeight: 599.7596

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1)C2=NN(C=C2C3C(=C(NC(=C3C(=O)OCC(C)C)C)C)C(=O)OCC(C)C)C4=CC=CC=C4)C

Isomeric SMILES

CCCOC1=CC(=C(C=C1)C2=NN(C=C2C3C(=C(NC(=C3C(=O)OCC(C)C)C)C)C(=O)OCC(C)C)C4=CC=CC=C4)C

InChI

InChI=1S/C36H45N3O5/c1-9-17-42-28-15-16-29(24(6)18-28)34-30(19-39(38-34)27-13-11-10-12-14-27)33-31(35(40)43-20-22(2)3)25(7)37-26(8)32(33)36(41)44-21-23(4)5/h10-16,18-19,22-23,33,37H,9,17,20-21H2,1-8H3