2,3-bis(oxidanyl)propyl 4-[4-(pentadecylamino)phenyl]butanoate

Systemtic Name: 2,3-bis(oxidanyl)propyl 4-[4-(pentadecylamino)phenyl]butanoate Openeye Name: 2,3-dihydroxypropyl 4-[4-(pentadecylamino)phenyl]butanoate CAS Name: 4-[4-(pentadecylamino)phenyl]butanoic acid 2,3-dihydroxypropyl ester IUPAC Name: 2,3-dihydroxypropyl 4-[4-(pentadecylamino)phenyl]butanoate Traditional Name: 4-[4-(pentadecylamino)phenyl]butyric acid glyceryl ester Formula: C28H49NO4 MolecularWeight: 463.69296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H49NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-22-29-26-20-18-25(19-21-26)16-15-17-28(32)33-24-27(31)23-30/h18-21,27,29-31H,2-17,22-24H2,1H3