[(E)-4-azanyl-3-ethanoyl-5-oxidanyl-2-oxidanylidene-icos-6-en-3-yl] ethanoate

Systemtic Name: [(E)-4-azanyl-3-ethanoyl-5-oxidanyl-2-oxidanylidene-icos-6-en-3-yl] ethanoate Openeye Name: [(E)-1,1-diacetyl-2-amino-3-hydroxy-octadec-4-enyl] acetate CAS Name: acetic acid [(E)-3-acetyl-4-amino-5-hydroxy-2-oxoeicos-6-en-3-yl] ester IUPAC Name: [(E)-3-acetyl-4-amino-5-hydroxy-2-oxoicos-6-en-3-yl] acetate Traditional Name: acetic acid [(E)-1,1-diacetyl-2-amino-3-hydroxy-octadec-4-enyl] ester Formula: C24H43NO5 MolecularWeight: 425.60192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC(C(C(C(=O)C)(C(=O)C)OC(=O)C)N)O

Isomeric SMILES

CCCCCCCCCCCCC/C=C/C(C(C(C(=O)C)(C(=O)C)OC(=O)C)N)O

InChI

InChI=1S/C24H43NO5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(29)23(25)24(19(2)26,20(3)27)30-21(4)28/h17-18,22-23,29H,5-16,25H2,1-4H3/b18-17+