4-[[2,5-bis(chloranyl)phenyl]amino]-2-(diethylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[2,5-bis(chloranyl)phenyl]amino]-2-(diethylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(2,5-dichloroanilino)-2-(diethylamino)-4-oxo-butanoic acid CAS Name: 4-(2,5-dichloroanilino)-2-(diethylamino)-4-oxobutanoic acid IUPAC Name: 4-(2,5-dichloroanilino)-2-(diethylamino)-4-oxobutanoic acid Traditional Name: 4-(2,5-dichloroanilino)-2-(diethylamino)-4-keto-butyric acid Formula: C14H18Cl2N2O3 MolecularWeight: 333.21032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18Cl2N2O3/c1-3-18(4-2)12(14(20)21)8-13(19)17-11-7-9(15)5-6-10(11)16/h5-7,12H,3-4,8H2,1-2H3,(H,17,19)(H,20,21)