dimethyl (4S)-2,6-dimethyl-4-(4-propoxyphenyl)-3,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dimethyl (4S)-2,6-dimethyl-4-(4-propoxyphenyl)-3,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl (4S)-2,6-dimethyl-4-(4-propoxyphenyl)-3,4-dihydropyridine-3,5-dicarboxylate CAS Name: (4S)-2,6-dimethyl-4-(4-propoxyphenyl)-3,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (4S)-2,6-dimethyl-4-(4-propoxyphenyl)-3,4-dihydropyridine-3,5-dicarboxylate Traditional Name: (4S)-2,6-dimethyl-4-(4-propoxyphenyl)-3,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2C(C(=NC(=C2C(=O)OC)C)C)C(=O)OC

Isomeric SMILES

CCCOC1=CC=C(C=C1)[C@@H]2C(C(=NC(=C2C(=O)OC)C)C)C(=O)OC

InChI

InChI=1S/C20H25NO5/c1-6-11-26-15-9-7-14(8-10-15)18-16(19(22)24-4)12(2)21-13(3)17(18)20(23)25-5/h7-10,16,18H,6,11H2,1-5H3/t16?,18-/m1/s1