butyl octadecanoate; 6-(methylamino)hexane-1,2,3,4,5-pentol

Systemtic Name: butyl octadecanoate; 6-(methylamino)hexane-1,2,3,4,5-pentol Openeye Name: butyl octadecanoate; 6-(methylamino)hexane-1,2,3,4,5-pentol CAS Name: 6-(methylamino)hexane-1,2,3,4,5-pentol; octadecanoic acid butyl ester IUPAC Name: butyl octadecanoate; 6-(methylamino)hexane-1,2,3,4,5-pentol Traditional Name: 6-(methylamino)hexane-1,2,3,4,5-pentol; stearic acid butyl ester Formula: C29H61NO7 MolecularWeight: 535.79714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCCCC.CNCC(C(C(C(CO)O)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCCCC.CNCC(C(C(C(CO)O)O)O)O

InChI

InChI=1S/C22H44O2.C7H17NO5/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22(23)24-21-6-4-2;1-8-2-4(10)6(12)7(13)5(11)3-9/h3-21H2,1-2H3;4-13H,2-3H2,1H3