2-[2-(3,4-dimethoxyphenyl)ethylamino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-6-oxidanylidene-hexanoic acid Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-6-oxo-hexanoic acid CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-6-oxohexanoic acid IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-6-oxohexanoic acid Traditional Name: 2-(homoveratrylamino)-6-keto-hexanoic acid Formula: C16H23NO5 MolecularWeight: 309.35752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO5/c1-21-14-7-6-12(11-15(14)22-2)8-9-17-13(16(19)20)5-3-4-10-18/h6-7,10-11,13,17H,3-5,8-9H2,1-2H3,(H,19,20)