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

Systemtic Name: 8-[methyl-[(2E,4E)-6-oxidanylhepta-2,4-dienyl]amino]-8-oxidanylidene-octanoic acid Openeye Name: 8-[[(2E,4E)-6-hydroxyhepta-2,4-dienyl]-methyl-amino]-8-oxo-octanoic acid CAS Name: 8-[[(2E,4E)-6-hydroxyhepta-2,4-dienyl]-methylamino]-8-oxooctanoic acid IUPAC Name: 8-[[(2E,4E)-6-hydroxyhepta-2,4-dienyl]-methylamino]-8-oxooctanoic acid Traditional Name: 8-[[(2E,4E)-6-hydroxyhepta-2,4-dienyl]-methyl-amino]-8-keto-caprylic acid Formula: C16H27NO4 MolecularWeight: 297.38988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27NO4/c1-14(18)10-6-5-9-13-17(2)15(19)11-7-3-4-8-12-16(20)21/h5-6,9-10,14,18H,3-4,7-8,11-13H2,1-2H3,(H,20,21)/b9-5+,10-6+