4-[2-(3-ethylphenoxy)ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[2-(3-ethylphenoxy)ethylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[2-(3-ethylphenoxy)ethylamino]-4-oxo-butanoate CAS Name: 4-[2-(3-ethylphenoxy)ethylamino]-4-oxobutanoate IUPAC Name: 4-[2-(3-ethylphenoxy)ethylamino]-4-oxobutanoate Traditional Name: 4-[2-(3-ethylphenoxy)ethylamino]-4-keto-butyrate Formula: C14H18NO4- MolecularWeight: 264.29702

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)OCCNC(=O)CCC(=O)[O-]

Isomeric SMILES

CCC1=CC(=CC=C1)OCCNC(=O)CCC(=O)[O-]

InChI

InChI=1S/C14H19NO4/c1-2-11-4-3-5-12(10-11)19-9-8-15-13(16)6-7-14(17)18/h3-5,10H,2,6-9H2,1H3,(H,15,16)(H,17,18)/p-1