2,3-bis(oxidanyl)propyl 4-[(16-methoxy-16-oxidanylidene-hexadecyl)amino]benzoate

Systemtic Name: 2,3-bis(oxidanyl)propyl 4-[(16-methoxy-16-oxidanylidene-hexadecyl)amino]benzoate Openeye Name: 2,3-dihydroxypropyl 4-[(16-methoxy-16-oxo-hexadecyl)amino]benzoate CAS Name: 4-[(16-methoxy-16-oxohexadecyl)amino]benzoic acid 2,3-dihydroxypropyl ester IUPAC Name: 2,3-dihydroxypropyl 4-[(16-methoxy-16-oxohexadecyl)amino]benzoate Traditional Name: 4-[(16-keto-16-methoxy-hexadecyl)amino]benzoic acid glyceryl ester Formula: C27H45NO6 MolecularWeight: 479.6493

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OCC(CO)O

Isomeric SMILES

COC(=O)CCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OCC(CO)O

InChI

InChI=1S/C27H45NO6/c1-33-26(31)15-13-11-9-7-5-3-2-4-6-8-10-12-14-20-28-24-18-16-23(17-19-24)27(32)34-22-25(30)21-29/h16-19,25,28-30H,2-15,20-22H2,1H3