5-[[(E)-2-oxidanylidene-1-phenyl-dodec-3-enoxy]amino]pentanoic acid

Systemtic Name: 5-[[(E)-2-oxidanylidene-1-phenyl-dodec-3-enoxy]amino]pentanoic acid Openeye Name: 5-[[(E)-2-oxo-1-phenyl-dodec-3-enoxy]amino]pentanoic acid CAS Name: 5-[[(E)-2-oxo-1-phenyldodec-3-enoxy]amino]pentanoic acid IUPAC Name: 5-[[(E)-2-oxo-1-phenyldodec-3-enoxy]amino]pentanoic acid Traditional Name: 5-[[(E)-2-keto-1-phenyl-dodec-3-enoxy]amino]valeric acid Formula: C23H35NO4 MolecularWeight: 389.5283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CC(=O)C(C1=CC=CC=C1)ONCCCCC(=O)O

Isomeric SMILES

CCCCCCCC/C=C/C(=O)C(C1=CC=CC=C1)ONCCCCC(=O)O

InChI

InChI=1S/C23H35NO4/c1-2-3-4-5-6-7-8-12-17-21(25)23(20-15-10-9-11-16-20)28-24-19-14-13-18-22(26)27/h9-12,15-17,23-24H,2-8,13-14,18-19H2,1H3,(H,26,27)/b17-12+