4-[[3-[dodecyl-(4-oxidanyl-4-oxidanylidene-butanoyl)amino]-2-oxidanyl-propyl]-hexyl-amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-[dodecyl-(4-oxidanyl-4-oxidanylidene-butanoyl)amino]-2-oxidanyl-propyl]-hexyl-amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[3-[dodecyl-(4-hydroxy-4-oxo-butanoyl)amino]-2-hydroxy-propyl]-hexyl-amino]-4-oxo-butanoic acid CAS Name: 4-[[3-[dodecyl-(4-hydroxy-1,4-dioxobutyl)amino]-2-hydroxypropyl]-hexylamino]-4-oxobutanoic acid IUPAC Name: 4-[[3-[dodecyl-(4-hydroxy-4-oxobutanoyl)amino]-2-hydroxypropyl]-hexylamino]-4-oxobutanoic acid Traditional Name: 4-[hexyl-[2-hydroxy-3-[(4-hydroxy-4-keto-butanoyl)-lauryl-amino]propyl]amino]-4-keto-butyric acid Formula: C29H54N2O7 MolecularWeight: 542.74826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(CC(CN(CCCCCC)C(=O)CCC(=O)O)O)C(=O)CCC(=O)O

Isomeric SMILES

CCCCCCCCCCCCN(CC(CN(CCCCCC)C(=O)CCC(=O)O)O)C(=O)CCC(=O)O

InChI

InChI=1S/C29H54N2O7/c1-3-5-7-9-10-11-12-13-14-16-22-31(27(34)18-20-29(37)38)24-25(32)23-30(21-15-8-6-4-2)26(33)17-19-28(35)36/h25,32H,3-24H2,1-2H3,(H,35,36)(H,37,38)