4-[2-(3,4-dimethoxyphenyl)ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-4-oxo-butanoate CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-4-oxobutanoate IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-4-oxobutanoate Traditional Name: 4-(homoveratrylamino)-4-keto-butyrate Formula: C14H18NO5- MolecularWeight: 280.29642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CCC(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CCC(=O)[O-])OC

InChI

InChI=1S/C14H19NO5/c1-19-11-4-3-10(9-12(11)20-2)7-8-15-13(16)5-6-14(17)18/h3-4,9H,5-8H2,1-2H3,(H,15,16)(H,17,18)/p-1