2-[[12-(5-methyl-2-oxidanyl-phenyl)-12-oxidanylidene-dodecanoyl]amino]ethanoic acid

Systemtic Name: 2-[[12-(5-methyl-2-oxidanyl-phenyl)-12-oxidanylidene-dodecanoyl]amino]ethanoic acid Openeye Name: 2-[[12-(2-hydroxy-5-methyl-phenyl)-12-oxo-dodecanoyl]amino]acetic acid CAS Name: 2-[[12-(2-hydroxy-5-methylphenyl)-1,12-dioxododecyl]amino]acetic acid IUPAC Name: 2-[[12-(2-hydroxy-5-methylphenyl)-12-oxododecanoyl]amino]acetic acid Traditional Name: 2-[[12-(2-hydroxy-5-methyl-phenyl)-12-keto-dodecanoyl]amino]acetic acid Formula: C21H31NO5 MolecularWeight: 377.47454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(=O)CCCCCCCCCCC(=O)NCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(=O)CCCCCCCCCCC(=O)NCC(=O)O

InChI

InChI=1S/C21H31NO5/c1-16-12-13-19(24)17(14-16)18(23)10-8-6-4-2-3-5-7-9-11-20(25)22-15-21(26)27/h12-14,24H,2-11,15H2,1H3,(H,22,25)(H,26,27)