5-[2-(3,4-dimethoxyphenyl)ethylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[2-(3,4-dimethoxyphenyl)ethylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[2-(3,4-dimethoxyphenyl)ethylamino]-5-oxo-pentanoic acid CAS Name: 5-[2-(3,4-dimethoxyphenyl)ethylamino]-5-oxopentanoic acid IUPAC Name: 5-[2-(3,4-dimethoxyphenyl)ethylamino]-5-oxopentanoic acid Traditional Name: 5-(homoveratrylamino)-5-keto-valeric acid Formula: C15H21NO5 MolecularWeight: 295.33094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CCCC(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CCCC(=O)O)OC

InChI

InChI=1S/C15H21NO5/c1-20-12-7-6-11(10-13(12)21-2)8-9-16-14(17)4-3-5-15(18)19/h6-7,10H,3-5,8-9H2,1-2H3,(H,16,17)(H,18,19)