2-(decanoylamino)-5-[methyl-[2-(prop-2-enoxycarbonylamino)ethyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-(decanoylamino)-5-[methyl-[2-(prop-2-enoxycarbonylamino)ethyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[2-(allyloxycarbonylamino)ethyl-methyl-amino]-2-(decanoylamino)-5-oxo-pentanoic acid CAS Name: 5-[methyl-[2-[[oxo(prop-2-enoxy)methyl]amino]ethyl]amino]-5-oxo-2-(1-oxodecylamino)pentanoic acid IUPAC Name: 2-(decanoylamino)-5-[methyl-[2-(prop-2-enoxycarbonylamino)ethyl]amino]-5-oxopentanoic acid Traditional Name: 5-[2-(allyloxycarbonylamino)ethyl-methyl-amino]-2-(caprylamino)-5-keto-valeric acid Formula: C22H39N3O6 MolecularWeight: 441.56156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)NC(CCC(=O)N(C)CCNC(=O)OCC=C)C(=O)O

Isomeric SMILES

CCCCCCCCCC(=O)NC(CCC(=O)N(C)CCNC(=O)OCC=C)C(=O)O

InChI

InChI=1S/C22H39N3O6/c1-4-6-7-8-9-10-11-12-19(26)24-18(21(28)29)13-14-20(27)25(3)16-15-23-22(30)31-17-5-2/h5,18H,2,4,6-17H2,1,3H3,(H,23,30)(H,24,26)(H,28,29)