2-[[2-(8-azanyloctanoylamino)-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-(8-azanyloctanoylamino)-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(8-aminooctanoylamino)-4-hydroxy-4-oxo-butanoyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-[(8-amino-1-oxooctyl)amino]-4-hydroxy-1,4-dioxobutyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(8-aminooctanoylamino)-4-hydroxy-4-oxobutanoyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(8-aminooctanoylamino)-4-hydroxy-4-keto-butanoyl]amino]-3-methyl-butyric acid Formula: C17H31N3O6 MolecularWeight: 373.44454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C(CC(=O)O)NC(=O)CCCCCCCN

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C(CC(=O)O)NC(=O)CCCCCCCN

InChI

InChI=1S/C17H31N3O6/c1-11(2)15(17(25)26)20-16(24)12(10-14(22)23)19-13(21)8-6-4-3-5-7-9-18/h11-12,15H,3-10,18H2,1-2H3,(H,19,21)(H,20,24)(H,22,23)(H,25,26)