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

Systemtic Name: 4-[(4-chloranyl-3-methoxycarbonyl-phenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-chloro-3-methoxycarbonyl-anilino)-4-oxo-butanoic acid CAS Name: 4-(4-chloro-3-methoxycarbonylanilino)-4-oxobutanoic acid IUPAC Name: 4-(4-chloro-3-methoxycarbonylanilino)-4-oxobutanoic acid Traditional Name: 4-(3-carbomethoxy-4-chloro-anilino)-4-keto-butyric acid Formula: C12H12ClNO5 MolecularWeight: 285.68038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12ClNO5/c1-19-12(18)8-6-7(2-3-9(8)13)14-10(15)4-5-11(16)17/h2-3,6H,4-5H2,1H3,(H,14,15)(H,16,17)