5-azanyl-2-[2-(octadecylamino)propanoylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[2-(octadecylamino)propanoylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[2-(octadecylamino)propanoylamino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[2-(octadecylamino)-1-oxopropyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[2-(octadecylamino)propanoylamino]-5-oxopentanoic acid Traditional Name: 5-amino-5-keto-2-[2-(stearylamino)propanoylamino]valeric acid Formula: C26H51N3O4 MolecularWeight: 469.70084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(C)C(=O)NC(CCC(=O)N)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(C)C(=O)NC(CCC(=O)N)C(=O)O

InChI

InChI=1S/C26H51N3O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-28-22(2)25(31)29-23(26(32)33)19-20-24(27)30/h22-23,28H,3-21H2,1-2H3,(H2,27,30)(H,29,31)(H,32,33)