5-azanyl-2-[[6-(decanoylamino)-1-methoxy-1-oxidanylidene-hexan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[[6-(decanoylamino)-1-methoxy-1-oxidanylidene-hexan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[[5-(decanoylamino)-1-methoxycarbonyl-pentyl]amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[1-methoxy-1-oxo-6-(1-oxodecylamino)hexan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[[6-(decanoylamino)-1-methoxy-1-oxohexan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[[5-(caprylamino)-1-carbomethoxy-pentyl]amino]-5-keto-valeric acid Formula: C22H41N3O6 MolecularWeight: 443.57744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)NCCCCC(C(=O)OC)NC(CCC(=O)N)C(=O)O

Isomeric SMILES

CCCCCCCCCC(=O)NCCCCC(C(=O)OC)NC(CCC(=O)N)C(=O)O

InChI

InChI=1S/C22H41N3O6/c1-3-4-5-6-7-8-9-13-20(27)24-16-11-10-12-18(22(30)31-2)25-17(21(28)29)14-15-19(23)26/h17-18,25H,3-16H2,1-2H3,(H2,23,26)(H,24,27)(H,28,29)