4-[2-(2-chloranylphenoxy)ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[2-(2-chloranylphenoxy)ethylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[2-(2-chlorophenoxy)ethylamino]-4-oxo-butanoate CAS Name: 4-[2-(2-chlorophenoxy)ethylamino]-4-oxobutanoate IUPAC Name: 4-[2-(2-chlorophenoxy)ethylamino]-4-oxobutanoate Traditional Name: 4-[2-(2-chlorophenoxy)ethylamino]-4-keto-butyrate Formula: C12H13ClNO4- MolecularWeight: 270.68892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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