sodium 1-[(Z)-octadec-9-enyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: sodium 1-[(Z)-octadec-9-enyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: sodium 1-[(Z)-octadec-9-enyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: sodium 1-[(Z)-octadec-9-enyl]-5-oxo-3-pyrrolidinecarboxylate IUPAC Name: sodium 1-[(Z)-octadec-9-enyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: sodium 5-keto-1-[(Z)-octadec-9-enyl]pyrrolidine-3-carboxylate Formula: C23H40NNaO3 MolecularWeight: 401.55837

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCN1CC(CC1=O)C(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCCN1CC(CC1=O)C(=O)[O-].[Na+]

InChI

InChI=1S/C23H41NO3.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-20-21(23(26)27)19-22(24)25;/h9-10,21H,2-8,11-20H2,1H3,(H,26,27);/q;+1/p-1/b10-9-;