5-[methyl(pyridin-2-yl)amino]-6-oxidanylidene-6-(16-oxidanylidenehexadecanoylamino)hexanoic acid

Systemtic Name: 5-[methyl(pyridin-2-yl)amino]-6-oxidanylidene-6-(16-oxidanylidenehexadecanoylamino)hexanoic acid Openeye Name: 5-[methyl(2-pyridyl)amino]-6-oxo-6-(16-oxohexadecanoylamino)hexanoic acid CAS Name: 6-(1,16-dioxohexadecylamino)-5-[methyl(2-pyridinyl)amino]-6-oxohexanoic acid IUPAC Name: 5-[methyl(pyridin-2-yl)amino]-6-oxo-6-(16-oxohexadecanoylamino)hexanoic acid Traditional Name: 6-keto-6-(16-ketohexadecanoylamino)-5-[methyl(2-pyridyl)amino]hexanoic acid Formula: C28H45N3O5 MolecularWeight: 503.674

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=N1)C(CCCC(=O)O)C(=O)NC(=O)CCCCCCCCCCCCCCC=O

Isomeric SMILES

CN(C1=CC=CC=N1)C(CCCC(=O)O)C(=O)NC(=O)CCCCCCCCCCCCCCC=O

InChI

InChI=1S/C28H45N3O5/c1-31(25-19-14-15-22-29-25)24(18-17-21-27(34)35)28(36)30-26(33)20-13-11-9-7-5-3-2-4-6-8-10-12-16-23-32/h14-15,19,22-24H,2-13,16-18,20-21H2,1H3,(H,34,35)(H,30,33,36)