1-(hydroxymethyl)-1-[(E)-octadec-1-enyl]pyrrolidin-1-ium-2,5-dione

Systemtic Name: 1-(hydroxymethyl)-1-[(E)-octadec-1-enyl]pyrrolidin-1-ium-2,5-dione Openeye Name: 1-(hydroxymethyl)-1-[(E)-octadec-1-enyl]pyrrolidin-1-ium-2,5-dione CAS Name: 1-(hydroxymethyl)-1-[(E)-octadec-1-enyl]pyrrolidin-1-ium-2,5-dione IUPAC Name: 1-(hydroxymethyl)-1-[(E)-octadec-1-enyl]pyrrolidin-1-ium-2,5-dione Traditional Name: 1-methylol-1-[(E)-octadec-1-enyl]pyrrolidin-1-ium-2,5-quinone Formula: C23H42NO3+ MolecularWeight: 380.58448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC=C[N+]1(C(=O)CCC1=O)CO

Isomeric SMILES

CCCCCCCCCCCCCCCC/C=C/[N+]1(C(=O)CCC1=O)CO

InChI

InChI=1S/C23H42NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-24(21-25)22(26)18-19-23(24)27/h17,20,25H,2-16,18-19,21H2,1H3/q+1/b20-17+