2,6-dimethyl-4-(2-methylphenyl)-5-[(E)-3-phenylprop-2-enoxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 2,6-dimethyl-4-(2-methylphenyl)-5-[(E)-3-phenylprop-2-enoxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 5-[(E)-cinnamyl]oxycarbonyl-2,6-dimethyl-4-(o-tolyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 2,6-dimethyl-4-(2-methylphenyl)-5-[oxo-[(E)-3-phenylprop-2-enoxy]methyl]-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 2,6-dimethyl-4-(2-methylphenyl)-5-[(E)-3-phenylprop-2-enoxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-[(E)-cinnamyl]oxycarbonyl-2,6-dimethyl-4-(o-tolyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C25H25NO4 MolecularWeight: 403.4703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C(=C(NC(=C2C(=O)OCC=CC3=CC=CC=C3)C)C)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2C(=C(NC(=C2C(=O)OC/C=C/C3=CC=CC=C3)C)C)C(=O)O

InChI

InChI=1S/C25H25NO4/c1-16-10-7-8-14-20(16)23-21(24(27)28)17(2)26-18(3)22(23)25(29)30-15-9-13-19-11-5-4-6-12-19/h4-14,23,26H,15H2,1-3H3,(H,27,28)/b13-9+