O5-methyl O3-propan-2-yl 4-(2-cyanophenyl)-2-(hydroxymethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-methyl O3-propan-2-yl 4-(2-cyanophenyl)-2-(hydroxymethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-isopropyl O5-methyl 4-(2-cyanophenyl)-2-(hydroxymethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(2-cyanophenyl)-2-(hydroxymethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-methyl ester O3-propan-2-yl ester IUPAC Name: 5-O-methyl 3-O-propan-2-yl 4-(2-cyanophenyl)-2-(hydroxymethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2-cyanophenyl)-2-methyl-6-methylol-1,4-dihydropyridine-3,5-dicarboxylic acid O5-isopropyl ester O3-methyl ester Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O5/c1-11(2)27-20(25)18-15(10-23)22-12(3)16(19(24)26-4)17(18)14-8-6-5-7-13(14)9-21/h5-8,11,17,22-23H,10H2,1-4H3