2-[4-(butylaminomethyl)-2-ethyl-phenoxy]ethanoate

Systemtic Name: 2-[4-(butylaminomethyl)-2-ethyl-phenoxy]ethanoate Openeye Name: 2-[4-(butylaminomethyl)-2-ethyl-phenoxy]acetate CAS Name: 2-[4-(butylaminomethyl)-2-ethylphenoxy]acetate IUPAC Name: 2-[4-(butylaminomethyl)-2-ethylphenoxy]acetate Traditional Name: 2-[4-(butylaminomethyl)-2-ethyl-phenoxy]acetate Formula: C15H22NO3- MolecularWeight: 264.34008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1=CC(=C(C=C1)OCC(=O)[O-])CC

Isomeric SMILES

CCCCNCC1=CC(=C(C=C1)OCC(=O)[O-])CC

InChI

InChI=1S/C15H23NO3/c1-3-5-8-16-10-12-6-7-14(13(4-2)9-12)19-11-15(17)18/h6-7,9,16H,3-5,8,10-11H2,1-2H3,(H,17,18)/p-1