4-[2-(3-ethoxy-4-hexoxy-phenyl)ethylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-(3-ethoxy-4-hexoxy-phenyl)ethylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-(3-ethoxy-4-hexoxy-phenyl)ethylamino]-4-oxo-butanoic acid CAS Name: 4-[2-(3-ethoxy-4-hexoxyphenyl)ethylamino]-4-oxobutanoic acid IUPAC Name: 4-[2-(3-ethoxy-4-hexoxyphenyl)ethylamino]-4-oxobutanoic acid Traditional Name: 4-[2-(3-ethoxy-4-hexoxy-phenyl)ethylamino]-4-keto-butyric acid Formula: C20H31NO5 MolecularWeight: 365.46384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)CCNC(=O)CCC(=O)O)OCC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)CCNC(=O)CCC(=O)O)OCC

InChI

InChI=1S/C20H31NO5/c1-3-5-6-7-14-26-17-9-8-16(15-18(17)25-4-2)12-13-21-19(22)10-11-20(23)24/h8-9,15H,3-7,10-14H2,1-2H3,(H,21,22)(H,23,24)