O3-(2,2-dimethylpropyl) O5-methyl 2-cyano-4-(2-cyanophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-(2,2-dimethylpropyl) O5-methyl 2-cyano-4-(2-cyanophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-(2,2-dimethylpropyl) O5-methyl 2-cyano-4-(2-cyanophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-cyano-4-(2-cyanophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-(2,2-dimethylpropyl) ester O5-methyl ester IUPAC Name: 3-O-(2,2-dimethylpropyl) 5-O-methyl 2-cyano-4-(2-cyanophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-cyano-4-(2-cyanophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-methyl ester O3-neopentyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C#N)C(=O)OCC(C)(C)C)C2=CC=CC=C2C#N)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C#N)C(=O)OCC(C)(C)C)C2=CC=CC=C2C#N)C(=O)OC

InChI

InChI=1S/C22H23N3O4/c1-13-17(20(26)28-5)18(15-9-7-6-8-14(15)10-23)19(16(11-24)25-13)21(27)29-12-22(2,3)4/h6-9,18,25H,12H2,1-5H3