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1-pyridin-1-ium-1-ylhexadecyl 2-methylprop-2-enoate chloride

1-pyridin-1-ium-1-ylhexadecyl 2-methylprop-2-enoate chloride

Systemtic Name:1-pyridin-1-ium-1-ylhexadecyl 2-methylprop-2-enoate chloride
Openeye Name:1-pyridin-1-ium-1-ylhexadecyl 2-methylprop-2-enoate chloride
CAS Name:2-methyl-2-propenoic acid 1-(1-pyridin-1-iumyl)hexadecyl ester chloride
IUPAC Name:1-pyridin-1-ium-1-ylhexadecyl 2-methylprop-2-enoate chloride
Traditional Name:2-methylacrylic acid 1-pyridin-1-ium-1-ylhexadecyl ester chloride
Formula: C25H42ClNO2
MolecularWeight: 424.05948
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC([N+]1=CC=CC=C1)OC(=O)C(=C)C.[Cl-]


Isomeric SMILES

CCCCCCCCCCCCCCCC([N+]1=CC=CC=C1)OC(=O)C(=C)C.[Cl-]


InChI

InChI=1S/C25H42NO2.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-17-20-24(28-25(27)23(2)3)26-21-18-16-19-22-26;/h16,18-19,21-22,24H,2,4-15,17,20H2,1,3H3;1H/q+1;/p-1


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