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butyl-[3-[(E)-3-(4-chlorophenyl)prop-2-enoyl]oxy-2-oxidanyl-propyl]-diethyl-azanium
butyl-[3-[(E)-3-(4-chlorophenyl)prop-2-enoyl]oxy-2-oxidanyl-propyl]-diethyl-azanium
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Descriptors Computed from Structure
Canonical SMILES:
CCCC[N+](CC)(CC)CC(COC(=O)C=CC1=CC=C(C=C1)Cl)O
Isomeric SMILES
CCCC[N+](CC)(CC)CC(COC(=O)/C=C/C1=CC=C(C=C1)Cl)O
InChI
InChI=1S/C20H31ClNO3/c1-4-7-14-22(5-2,6-3)15-19(23)16-25-20(24)13-10-17-8-11-18(21)12-9-17/h8-13,19,23H,4-7,14-16H2,1-3H3/q+1/b13-10+
Other Product
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