4-[4-(13,13-dimethyltetradecylamino)phenyl]-2,3-bis(oxidanyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-(13,13-dimethyltetradecylamino)phenyl]-2,3-bis(oxidanyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(13,13-dimethyltetradecylamino)phenyl]-2,3-dihydroxy-4-oxo-butanoic acid CAS Name: 4-[4-(13,13-dimethyltetradecylamino)phenyl]-2,3-dihydroxy-4-oxobutanoic acid IUPAC Name: 4-[4-(13,13-dimethyltetradecylamino)phenyl]-2,3-dihydroxy-4-oxobutanoic acid Traditional Name: 4-[4-(13,13-dimethyltetradecylamino)phenyl]-2,3-dihydroxy-4-keto-butyric acid Formula: C26H43NO5 MolecularWeight: 449.62332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)C(C(C(=O)O)O)O

Isomeric SMILES

CC(C)(C)CCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)C(C(C(=O)O)O)O

InChI

InChI=1S/C26H43NO5/c1-26(2,3)18-12-10-8-6-4-5-7-9-11-13-19-27-21-16-14-20(15-17-21)22(28)23(29)24(30)25(31)32/h14-17,23-24,27,29-30H,4-13,18-19H2,1-3H3,(H,31,32)