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hexadecyl-methyl-[2-[methyl(propyl)carbamoyl]prop-2-enyl]azanium bromide

hexadecyl-methyl-[2-[methyl(propyl)carbamoyl]prop-2-enyl]azanium bromide

Systemtic Name:hexadecyl-methyl-[2-[methyl(propyl)carbamoyl]prop-2-enyl]azanium bromide
Openeye Name:hexadecyl-methyl-[2-[methyl(propyl)carbamoyl]allyl]ammonium bromide
CAS Name:hexadecyl-methyl-[2-[[methyl(propyl)amino]-oxomethyl]prop-2-enyl]ammonium bromide
IUPAC Name:hexadecyl-methyl-[2-[methyl(propyl)carbamoyl]prop-2-enyl]azanium bromide
Traditional Name:cetyl-methyl-[2-[methyl(propyl)carbamoyl]allyl]ammonium bromide
Formula: C25H51BrN2O
MolecularWeight: 475.58924
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[NH+](C)CC(=C)C(=O)N(C)CCC.[Br-]


Isomeric SMILES

CCCCCCCCCCCCCCCC[NH+](C)CC(=C)C(=O)N(C)CCC.[Br-]


InChI

InChI=1S/C25H50N2O.BrH/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-22-26(4)23-24(3)25(28)27(5)21-7-2;/h3,6-23H2,1-2,4-5H3;1H


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