4-(2-chloranyl-6-fluoranyl-phenyl)-5-(2-methoxyethoxycarbonyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 4-(2-chloranyl-6-fluoranyl-phenyl)-5-(2-methoxyethoxycarbonyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 4-(2-chloro-6-fluoro-phenyl)-5-(2-methoxyethoxycarbonyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 4-(2-chloro-6-fluorophenyl)-5-[2-methoxyethoxy(oxo)methyl]-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 4-(2-chloro-6-fluorophenyl)-5-(2-methoxyethoxycarbonyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 4-(2-chloro-6-fluoro-phenyl)-5-(2-methoxyethoxycarbonyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Formula: C18H19ClFNO5 MolecularWeight: 383.798563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCCOC)C2=C(C=CC=C2Cl)F)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OCCOC)C2=C(C=CC=C2Cl)F)C(=O)O

InChI

InChI=1S/C18H19ClFNO5/c1-9-13(17(22)23)16(15-11(19)5-4-6-12(15)20)14(10(2)21-9)18(24)26-8-7-25-3/h4-6,16,21H,7-8H2,1-3H3,(H,22,23)