2-[4-(hexadecylamino)phenyl]carbonyloxypropanoic acid

Systemtic Name: 2-[4-(hexadecylamino)phenyl]carbonyloxypropanoic acid Openeye Name: 2-[4-(hexadecylamino)benzoyl]oxypropanoic acid CAS Name: 2-[[4-(hexadecylamino)phenyl]-oxomethoxy]propanoic acid IUPAC Name: 2-[4-(hexadecylamino)benzoyl]oxypropanoic acid Traditional Name: 2-[4-(cetylamino)benzoyl]oxypropionic acid Formula: C26H43NO4 MolecularWeight: 433.62392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OC(C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OC(C)C(=O)O

InChI

InChI=1S/C26H43NO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-27-24-19-17-23(18-20-24)26(30)31-22(2)25(28)29/h17-20,22,27H,3-16,21H2,1-2H3,(H,28,29)