bis(phenylmethyl) 2,6-dimethyl-4-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: bis(phenylmethyl) 2,6-dimethyl-4-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dibenzyl 4-[3-(4-benzyloxyphenyl)-1-phenyl-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-[1-phenyl-3-(4-phenylmethoxyphenyl)-4-pyrazolyl]-1,4-dihydropyridine-3,5-dicarboxylic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2,6-dimethyl-4-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-[3-(4-benzoxyphenyl)-1-phenyl-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid dibenzyl ester Formula: C45H39N3O5 MolecularWeight: 701.80826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCC2=CC=CC=C2)C3=CN(N=C3C4=CC=C(C=C4)OCC5=CC=CC=C5)C6=CC=CC=C6)C(=O)OCC7=CC=CC=C7

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OCC2=CC=CC=C2)C3=CN(N=C3C4=CC=C(C=C4)OCC5=CC=CC=C5)C6=CC=CC=C6)C(=O)OCC7=CC=CC=C7

InChI

InChI=1S/C45H39N3O5/c1-31-40(44(49)52-29-34-17-9-4-10-18-34)42(41(32(2)46-31)45(50)53-30-35-19-11-5-12-20-35)39-27-48(37-21-13-6-14-22-37)47-43(39)36-23-25-38(26-24-36)51-28-33-15-7-3-8-16-33/h3-27,42,46H,28-30H2,1-2H3