2-[[(E)-octadec-9-enoyl]amino]hexanedioic acid

Systemtic Name: 2-[[(E)-octadec-9-enoyl]amino]hexanedioic acid Openeye Name: 2-[[(E)-octadec-9-enoyl]amino]hexanedioic acid CAS Name: 2-[[(E)-1-oxooctadec-9-enyl]amino]hexanedioic acid IUPAC Name: 2-[[(E)-octadec-9-enoyl]amino]hexanedioic acid Traditional Name: 2-[[(E)-octadec-9-enoyl]amino]adipic acid Formula: C24H43NO5 MolecularWeight: 425.60192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NC(CCCC(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)NC(CCCC(=O)O)C(=O)O

InChI

InChI=1S/C24H43NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(26)25-21(24(29)30)18-17-20-23(27)28/h9-10,21H,2-8,11-20H2,1H3,(H,25,26)(H,27,28)(H,29,30)/b10-9+