2,3-bis(oxidanyl)propyl 3-(hexadecylamino)benzoate

Systemtic Name: 2,3-bis(oxidanyl)propyl 3-(hexadecylamino)benzoate Openeye Name: 2,3-dihydroxypropyl 3-(hexadecylamino)benzoate CAS Name: 3-(hexadecylamino)benzoic acid 2,3-dihydroxypropyl ester IUPAC Name: 2,3-dihydroxypropyl 3-(hexadecylamino)benzoate Traditional Name: 3-(cetylamino)benzoic acid glyceryl ester Formula: C26H45NO4 MolecularWeight: 435.6398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC=CC(=C1)C(=O)OCC(CO)O

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC=CC(=C1)C(=O)OCC(CO)O

InChI

InChI=1S/C26H45NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-27-24-18-16-17-23(20-24)26(30)31-22-25(29)21-28/h16-18,20,25,27-29H,2-15,19,21-22H2,1H3