4-[(2,4-dichlorophenyl)amino]-2-(dimethylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(2,4-dichlorophenyl)amino]-2-(dimethylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(2,4-dichloroanilino)-2-(dimethylamino)-4-oxo-butanoic acid CAS Name: 4-(2,4-dichloroanilino)-2-(dimethylamino)-4-oxobutanoic acid IUPAC Name: 4-(2,4-dichloroanilino)-2-(dimethylamino)-4-oxobutanoic acid Traditional Name: 4-(2,4-dichloroanilino)-2-(dimethylamino)-4-keto-butyric acid Formula: C12H14Cl2N2O3 MolecularWeight: 305.15716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CC(=O)NC1=C(C=C(C=C1)Cl)Cl)C(=O)O

Isomeric SMILES

CN(C)C(CC(=O)NC1=C(C=C(C=C1)Cl)Cl)C(=O)O

InChI

InChI=1S/C12H14Cl2N2O3/c1-16(2)10(12(18)19)6-11(17)15-9-4-3-7(13)5-8(9)14/h3-5,10H,6H2,1-2H3,(H,15,17)(H,18,19)