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

Systemtic Name: 4-[[2,5-bis(chloranyl)phenyl]amino]-4-oxidanylidene-2-(propan-2-ylamino)butanoic acid Openeye Name: 4-(2,5-dichloroanilino)-2-(isopropylamino)-4-oxo-butanoic acid CAS Name: 4-(2,5-dichloroanilino)-4-oxo-2-(propan-2-ylamino)butanoic acid IUPAC Name: 4-(2,5-dichloroanilino)-4-oxo-2-(propan-2-ylamino)butanoic acid Traditional Name: 4-(2,5-dichloroanilino)-2-(isopropylamino)-4-keto-butyric acid Formula: C13H16Cl2N2O3 MolecularWeight: 319.18374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16Cl2N2O3/c1-7(2)16-11(13(19)20)6-12(18)17-10-5-8(14)3-4-9(10)15/h3-5,7,11,16H,6H2,1-2H3,(H,17,18)(H,19,20)