2,3-bis(oxidanyl)propyl 5-oxidanylidenepyrrolidine-2-carboxylate; (E)-octadec-9-enoic acid

Systemtic Name: 2,3-bis(oxidanyl)propyl 5-oxidanylidenepyrrolidine-2-carboxylate; (E)-octadec-9-enoic acid Openeye Name: 2,3-dihydroxypropyl 5-oxopyrrolidine-2-carboxylate; (E)-octadec-9-enoic acid CAS Name: (E)-9-octadecenoic acid; 5-oxo-2-pyrrolidinecarboxylic acid 2,3-dihydroxypropyl ester IUPAC Name: 2,3-dihydroxypropyl 5-oxopyrrolidine-2-carboxylate; (E)-octadec-9-enoic acid Traditional Name: elaidic acid; 5-ketopyrrolidine-2-carboxylic acid glyceryl ester Formula: C26H47NO7 MolecularWeight: 485.65388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)O.C1CC(=O)NC1C(=O)OCC(CO)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)O.C1CC(=O)NC1C(=O)OCC(CO)O

InChI

InChI=1S/C18H34O2.C8H13NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;10-3-5(11)4-14-8(13)6-1-2-7(12)9-6/h9-10H,2-8,11-17H2,1H3,(H,19,20);5-6,10-11H,1-4H2,(H,9,12)/b10-9+;