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

Systemtic Name: 2-[2-[2-[[(E)-octadec-9-enoyl]amino]propanoylamino]propanoylamino]propanoic acid Openeye Name: 2-[2-[2-[[(E)-octadec-9-enoyl]amino]propanoylamino]propanoylamino]propanoic acid CAS Name: 2-[[1-oxo-2-[[1-oxo-2-[[(E)-1-oxooctadec-9-enyl]amino]propyl]amino]propyl]amino]propanoic acid IUPAC Name: 2-[2-[2-[[(E)-octadec-9-enoyl]amino]propanoylamino]propanoylamino]propanoic acid Traditional Name: 2-[2-[2-[[(E)-octadec-9-enoyl]amino]propanoylamino]propanoylamino]propionic acid Formula: C27H49N3O5 MolecularWeight: 495.69506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H49N3O5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24(31)28-21(2)25(32)29-22(3)26(33)30-23(4)27(34)35/h12-13,21-23H,5-11,14-20H2,1-4H3,(H,28,31)(H,29,32)(H,30,33)(H,34,35)/b13-12+