4-(3-chlorophenyl)-2,6-dimethyl-5-[(E)-3-pyridin-2-ylprop-2-enoxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-[(E)-3-pyridin-2-ylprop-2-enoxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-[(E)-3-(2-pyridyl)allyloxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-[oxo-[(E)-3-(2-pyridinyl)prop-2-enoxy]methyl]-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-[(E)-3-pyridin-2-ylprop-2-enoxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 4-(3-chlorophenyl)-2,6-dimethyl-5-[(E)-3-(2-pyridyl)allyloxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid Formula: C23H21ClN2O4 MolecularWeight: 424.87684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCC=CC2=CC=CC=N2)C3=CC(=CC=C3)Cl)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC/C=C/C2=CC=CC=N2)C3=CC(=CC=C3)Cl)C(=O)O

InChI

InChI=1S/C23H21ClN2O4/c1-14-19(22(27)28)21(16-7-5-8-17(24)13-16)20(15(2)26-14)23(29)30-12-6-10-18-9-3-4-11-25-18/h3-11,13,21,26H,12H2,1-2H3,(H,27,28)/b10-6+