1-[[(E)-12-oxidanyloctadec-9-enoyl]amino]propyl 2-methoxy-2-methyl-propanoate

Systemtic Name: 1-[[(E)-12-oxidanyloctadec-9-enoyl]amino]propyl 2-methoxy-2-methyl-propanoate Openeye Name: 1-[[(E)-12-hydroxyoctadec-9-enoyl]amino]propyl 2-methoxy-2-methyl-propanoate CAS Name: 2-methoxy-2-methylpropanoic acid 1-[[(E)-12-hydroxy-1-oxooctadec-9-enyl]amino]propyl ester IUPAC Name: 1-[[(E)-12-hydroxyoctadec-9-enoyl]amino]propyl 2-methoxy-2-methylpropanoate Traditional Name: 2-methoxy-2-methyl-propionic acid 1-[[(E)-12-hydroxyoctadec-9-enoyl]amino]propyl ester Formula: C26H49NO5 MolecularWeight: 455.67096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC=CCCCCCCCC(=O)NC(CC)OC(=O)C(C)(C)OC)O

Isomeric SMILES

CCCCCCC(C/C=C/CCCCCCCC(=O)NC(CC)OC(=O)C(C)(C)OC)O

InChI

InChI=1S/C26H49NO5/c1-6-8-9-16-19-22(28)20-17-14-12-10-11-13-15-18-21-23(29)27-24(7-2)32-25(30)26(3,4)31-5/h14,17,22,24,28H,6-13,15-16,18-21H2,1-5H3,(H,27,29)/b17-14+