4-[2-(4-chloranyl-2-methyl-phenoxy)ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[2-(4-chloranyl-2-methyl-phenoxy)ethylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[2-(4-chloro-2-methyl-phenoxy)ethylamino]-4-oxo-butanoate CAS Name: 4-[2-(4-chloro-2-methylphenoxy)ethylamino]-4-oxobutanoate IUPAC Name: 4-[2-(4-chloro-2-methylphenoxy)ethylamino]-4-oxobutanoate Traditional Name: 4-[2-(4-chloro-2-methyl-phenoxy)ethylamino]-4-keto-butyrate Formula: C13H15ClNO4- MolecularWeight: 284.7155

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCNC(=O)CCC(=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCNC(=O)CCC(=O)[O-]

InChI

InChI=1S/C13H16ClNO4/c1-9-8-10(14)2-3-11(9)19-7-6-15-12(16)4-5-13(17)18/h2-3,8H,4-7H2,1H3,(H,15,16)(H,17,18)/p-1