N,N-dimethyldodecan-1-amine oxide; [(E)-octadec-9-enyl] 2-(methylamino)ethanoate

Systemtic Name: N,N-dimethyldodecan-1-amine oxide; [(E)-octadec-9-enyl] 2-(methylamino)ethanoate Openeye Name: N,N-dimethyldodecan-1-amine oxide; [(E)-octadec-9-enyl] 2-(methylamino)acetate CAS Name: N,N-dimethyl-1-dodecanamine oxide; 2-(methylamino)acetic acid [(E)-octadec-9-enyl] ester IUPAC Name: N,N-dimethyldodecan-1-amine oxide; [(E)-octadec-9-enyl] 2-(methylamino)acetate Traditional Name: N,N-dimethyldodecan-1-amine oxide; 2-(methylamino)acetic acid [(E)-octadec-9-enyl] ester Formula: C35H72N2O3 MolecularWeight: 568.95778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](C)(C)[O-].CCCCCCCCC=CCCCCCCCCOC(=O)CNC

Isomeric SMILES

CCCCCCCCCCCC[N+](C)(C)[O-].CCCCCCCC/C=C/CCCCCCCCOC(=O)CNC

InChI

InChI=1S/C21H41NO2.C14H31NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-21(23)20-22-2;1-4-5-6-7-8-9-10-11-12-13-14-15(2,3)16/h10-11,22H,3-9,12-20H2,1-2H3;4-14H2,1-3H3/b11-10+;