hexadecyl 3-azanylpropanoate; 5-oxidanylidenepyrrolidine-2-carboxylic acid

Systemtic Name: hexadecyl 3-azanylpropanoate; 5-oxidanylidenepyrrolidine-2-carboxylic acid Openeye Name: hexadecyl 3-aminopropanoate; 5-oxopyrrolidine-2-carboxylic acid CAS Name: 3-aminopropanoic acid hexadecyl ester; 5-oxo-2-pyrrolidinecarboxylic acid IUPAC Name: hexadecyl 3-aminopropanoate; 5-oxopyrrolidine-2-carboxylic acid Traditional Name: 3-aminopropionic acid cetyl ester; pyroglutamic acid Formula: C24H46N2O5 MolecularWeight: 442.63244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)CCN.C1CC(=O)NC1C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)CCN.C1CC(=O)NC1C(=O)O

InChI

InChI=1S/C19H39NO2.C5H7NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-22-19(21)16-17-20;7-4-2-1-3(6-4)5(8)9/h2-18,20H2,1H3;3H,1-2H2,(H,6,7)(H,8,9)