4-[(3-acetamido-4-chloranyl-phenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-acetamido-4-chloranyl-phenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(3-acetamido-4-chloro-anilino)-4-oxo-butanoic acid CAS Name: 4-(3-acetamido-4-chloroanilino)-4-oxobutanoic acid IUPAC Name: 4-(3-acetamido-4-chloroanilino)-4-oxobutanoic acid Traditional Name: 4-(3-acetamido-4-chloro-anilino)-4-keto-butyric acid Formula: C12H13ClN2O4 MolecularWeight: 284.69562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13ClN2O4/c1-7(16)14-10-6-8(2-3-9(10)13)15-11(17)4-5-12(18)19/h2-3,6H,4-5H2,1H3,(H,14,16)(H,15,17)(H,18,19)