2-[4-(11-methyldodecylamino)phenyl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[4-(11-methyldodecylamino)phenyl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-(11-methyldodecylamino)phenyl]-2-oxo-acetic acid CAS Name: 2-[4-(11-methyldodecylamino)phenyl]-2-oxoacetic acid IUPAC Name: 2-[4-(11-methyldodecylamino)phenyl]-2-oxoacetic acid Traditional Name: 2-keto-2-[4-(11-methyldodecylamino)phenyl]acetic acid Formula: C21H33NO3 MolecularWeight: 347.49162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCNC1=CC=C(C=C1)C(=O)C(=O)O

Isomeric SMILES

CC(C)CCCCCCCCCCNC1=CC=C(C=C1)C(=O)C(=O)O

InChI

InChI=1S/C21H33NO3/c1-17(2)11-9-7-5-3-4-6-8-10-16-22-19-14-12-18(13-15-19)20(23)21(24)25/h12-15,17,22H,3-11,16H2,1-2H3,(H,24,25)