4-[2,3-bis(chloranyl)phenyl]-2,6-dimethyl-5-propoxycarbonyl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 4-[2,3-bis(chloranyl)phenyl]-2,6-dimethyl-5-propoxycarbonyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 4-(2,3-dichlorophenyl)-2,6-dimethyl-5-propoxycarbonyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 4-(2,3-dichlorophenyl)-2,6-dimethyl-5-[oxo(propoxy)methyl]-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 4-(2,3-dichlorophenyl)-2,6-dimethyl-5-propoxycarbonyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 4-(2,3-dichlorophenyl)-2,6-dimethyl-5-propoxycarbonyl-1,4-dihydropyridine-3-carboxylic acid Formula: C18H19Cl2NO4 MolecularWeight: 384.25376

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(NC(=C(C1C2=C(C(=CC=C2)Cl)Cl)C(=O)O)C)C

Isomeric SMILES

CCCOC(=O)C1=C(NC(=C(C1C2=C(C(=CC=C2)Cl)Cl)C(=O)O)C)C

InChI

InChI=1S/C18H19Cl2NO4/c1-4-8-25-18(24)14-10(3)21-9(2)13(17(22)23)15(14)11-6-5-7-12(19)16(11)20/h5-7,15,21H,4,8H2,1-3H3,(H,22,23)