8-[methyl-[(2E,4E)-6-oxidanylundeca-2,4-dienyl]amino]-8-oxidanylidene-octanoic acid

Systemtic Name: 8-[methyl-[(2E,4E)-6-oxidanylundeca-2,4-dienyl]amino]-8-oxidanylidene-octanoic acid Openeye Name: 8-[[(2E,4E)-6-hydroxyundeca-2,4-dienyl]-methyl-amino]-8-oxo-octanoic acid CAS Name: 8-[[(2E,4E)-6-hydroxyundeca-2,4-dienyl]-methylamino]-8-oxooctanoic acid IUPAC Name: 8-[[(2E,4E)-6-hydroxyundeca-2,4-dienyl]-methylamino]-8-oxooctanoic acid Traditional Name: 8-[[(2E,4E)-6-hydroxyundeca-2,4-dienyl]-methyl-amino]-8-keto-caprylic acid Formula: C20H35NO4 MolecularWeight: 353.4962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC=CCN(C)C(=O)CCCCCCC(=O)O)O

Isomeric SMILES

CCCCCC(/C=C/C=C/CN(C)C(=O)CCCCCCC(=O)O)O

InChI

InChI=1S/C20H35NO4/c1-3-4-8-13-18(22)14-9-7-12-17-21(2)19(23)15-10-5-6-11-16-20(24)25/h7,9,12,14,18,22H,3-6,8,10-11,13,15-17H2,1-2H3,(H,24,25)/b12-7+,14-9+