oxidanidyl(pentacosan-13-yl)azanium dihydrate

Systemtic Name: oxidanidyl(pentacosan-13-yl)azanium dihydrate Openeye Name: 1-dodecyltridecyl(oxido)ammonium dihydrate CAS Name: oxido(pentacosan-13-yl)ammonium dihydrate IUPAC Name: oxido(pentacosan-13-yl)azanium dihydrate Traditional Name: 1-lauryltridecyl(oxido)ammonium dihydrate Formula: C25H57NO3 MolecularWeight: 419.72498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCCCCCCCCCC)[NH2+][O-].O.O

Isomeric SMILES

CCCCCCCCCCCCC(CCCCCCCCCCCC)[NH2+][O-].O.O

InChI

InChI=1S/C25H53NO.2H2O/c1-3-5-7-9-11-13-15-17-19-21-23-25(26-27)24-22-20-18-16-14-12-10-8-6-4-2;;/h25H,3-24,26H2,1-2H3;2*1H2