(E)-4-[[6-(dodecanoylamino)-1-ethoxy-1-oxidanylidene-hexan-2-yl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[6-(dodecanoylamino)-1-ethoxy-1-oxidanylidene-hexan-2-yl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[[5-(dodecanoylamino)-1-ethoxycarbonyl-pentyl]amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[1-ethoxy-1-oxo-6-(1-oxododecylamino)hexan-2-yl]amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[[6-(dodecanoylamino)-1-ethoxy-1-oxohexan-2-yl]amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[[1-carbethoxy-5-(lauroylamino)pentyl]amino]-4-keto-but-2-enoic acid Formula: C24H42N2O6 MolecularWeight: 454.60008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NCCCCC(C(=O)OCC)NC(=O)C=CC(=O)O

Isomeric SMILES

CCCCCCCCCCCC(=O)NCCCCC(C(=O)OCC)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C24H42N2O6/c1-3-5-6-7-8-9-10-11-12-16-21(27)25-19-14-13-15-20(24(31)32-4-2)26-22(28)17-18-23(29)30/h17-18,20H,3-16,19H2,1-2H3,(H,25,27)(H,26,28)(H,29,30)/b18-17+