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

Systemtic Name: 4-(3-chlorophenyl)-5-[(E)-3-phenylprop-2-enoxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 4-(3-chlorophenyl)-5-[(E)-cinnamyl]oxycarbonyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 4-(3-chlorophenyl)-5-[oxo-[(E)-3-phenylprop-2-enoxy]methyl]-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 4-(3-chlorophenyl)-5-[(E)-3-phenylprop-2-enoxy]carbonyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 4-(3-chlorophenyl)-5-[(E)-cinnamyl]oxycarbonyl-1,4-dihydropyridine-3-carboxylic acid Formula: C22H18ClNO4 MolecularWeight: 395.83562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCOC(=O)C2=CNC=C(C2C3=CC(=CC=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)/C=C/COC(=O)C2=CNC=C(C2C3=CC(=CC=C3)Cl)C(=O)O

InChI

InChI=1S/C22H18ClNO4/c23-17-10-4-9-16(12-17)20-18(21(25)26)13-24-14-19(20)22(27)28-11-5-8-15-6-2-1-3-7-15/h1-10,12-14,20,24H,11H2,(H,25,26)/b8-5+