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

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

Systemtic Name:1-pyridin-1-ium-1-yloctadecyl 2-methylprop-2-enoate chloride
Openeye Name:1-pyridin-1-ium-1-yloctadecyl 2-methylprop-2-enoate chloride
CAS Name:2-methyl-2-propenoic acid 1-(1-pyridin-1-iumyl)octadecyl ester chloride
IUPAC Name:1-pyridin-1-ium-1-yloctadecyl 2-methylprop-2-enoate chloride
Traditional Name:2-methylacrylic acid 1-pyridin-1-ium-1-yloctadecyl ester chloride
Formula: C27H46ClNO2
MolecularWeight: 452.11264
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C27H46NO2.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22-26(30-27(29)25(2)3)28-23-20-18-21-24-28;/h18,20-21,23-24,26H,2,4-17,19,22H2,1,3H3;1H/q+1;/p-1


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