hexadecyl 2-[[3,5-bis(oxidanyl)phenyl]amino]propanoate

Systemtic Name: hexadecyl 2-[[3,5-bis(oxidanyl)phenyl]amino]propanoate Openeye Name: hexadecyl 2-(3,5-dihydroxyanilino)propanoate CAS Name: 2-(3,5-dihydroxyanilino)propanoic acid hexadecyl ester IUPAC Name: hexadecyl 2-(3,5-dihydroxyanilino)propanoate Traditional Name: 2-(3,5-dihydroxyanilino)propionic acid cetyl ester Formula: C25H43NO4 MolecularWeight: 421.61322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C(C)NC1=CC(=CC(=C1)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)C(C)NC1=CC(=CC(=C1)O)O

InChI

InChI=1S/C25H43NO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-30-25(29)21(2)26-22-18-23(27)20-24(28)19-22/h18-21,26-28H,3-17H2,1-2H3