(Q76755692)

English

[(1S,2S,4R,5S)-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl] 2-propylpentanoate

group of stereoisomers with the chemical formula C₁₇H₃₀NO₃⁺

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Statements

group of stereoisomers

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chemical compound

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296.22202024009 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₁₇H₃₀NO₃⁺

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based on heuristic

inferred from SMILES

canonical SMILES

CCCC(CCC)C(=O)OC1CC2C3OC3C(C1)[N+]2(C)C

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CCCC(CCC)C(=O)OC1C[C@H]2[C@@H]3[C@@H](O3)[C@H](C1)[N+]2(C)C

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Identifiers

InChI=1S/C17H30NO3/c1-5-7-11(8-6-2)17(19)20-12-9-13-15-16(21-15)14(10-12)18(13,3)4/h11-16H,5-10H2,1-4H3/q+1/t12?,13-,14-,15-,16+/m0/s1

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PPCMECAWCIQWHM-NYGOIYDISA-N

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UniChem compound ID

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