11-[3-[4-methyl-2,5-bis(oxidanyl)phenyl]propanoylamino]undecanoic acid

Systemtic Name: 11-[3-[4-methyl-2,5-bis(oxidanyl)phenyl]propanoylamino]undecanoic acid Openeye Name: 11-[3-(2,5-dihydroxy-4-methyl-phenyl)propanoylamino]undecanoic acid CAS Name: 11-[[3-(2,5-dihydroxy-4-methylphenyl)-1-oxopropyl]amino]undecanoic acid IUPAC Name: 11-[3-(2,5-dihydroxy-4-methylphenyl)propanoylamino]undecanoic acid Traditional Name: 11-[3-(2,5-dihydroxy-4-methyl-phenyl)propanoylamino]undecanoic acid Formula: C21H33NO5 MolecularWeight: 379.49042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1O)CCC(=O)NCCCCCCCCCCC(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1O)CCC(=O)NCCCCCCCCCCC(=O)O)O

InChI

InChI=1S/C21H33NO5/c1-16-14-19(24)17(15-18(16)23)11-12-20(25)22-13-9-7-5-3-2-4-6-8-10-21(26)27/h14-15,23-24H,2-13H2,1H3,(H,22,25)(H,26,27)