4-[2-(5-chloranyl-2-oxidanyl-phenyl)ethylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-(5-chloranyl-2-oxidanyl-phenyl)ethylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-(5-chloro-2-hydroxy-phenyl)ethylamino]-4-oxo-butanoic acid CAS Name: 4-[2-(5-chloro-2-hydroxyphenyl)ethylamino]-4-oxobutanoic acid IUPAC Name: 4-[2-(5-chloro-2-hydroxyphenyl)ethylamino]-4-oxobutanoic acid Traditional Name: 4-[2-(5-chloro-2-hydroxy-phenyl)ethylamino]-4-keto-butyric acid Formula: C12H14ClNO4 MolecularWeight: 271.69686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)CCNC(=O)CCC(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1Cl)CCNC(=O)CCC(=O)O)O

InChI

InChI=1S/C12H14ClNO4/c13-9-1-2-10(15)8(7-9)5-6-14-11(16)3-4-12(17)18/h1-2,7,15H,3-6H2,(H,14,16)(H,17,18)