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1,3-benzodioxol-5-yl-[(3S)-1-(2-hydroxyethyl)piperidin-1-ium-3-yl]methanone
1,3-benzodioxol-5-yl-[(3S)-1-(2-hydroxyethyl)piperidin-1-ium-3-yl]methanone
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Descriptors Computed from Structure
Canonical SMILES:
C1CC(C[NH+](C1)CCO)C(=O)C2=CC3=C(C=C2)OCO3
Isomeric SMILES
C1C[C@@H](C[NH+](C1)CCO)C(=O)C2=CC3=C(C=C2)OCO3
InChI
InChI=1S/C15H19NO4/c17-7-6-16-5-1-2-12(9-16)15(18)11-3-4-13-14(8-11)20-10-19-13/h3-4,8,12,17H,1-2,5-7,9-10H2/p+1/t12-/m0/s1
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- 2-oxidanylidene-3-sulfanyl-propanoic acid
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- 2-azanyl-3-oxidanyl-benzoic acid
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- (2-azanylpyridin-1-ium-4-yl)-[(5R)-9-[(3-methoxyphenyl)methyl]-3-aza-9-azoniaspiro[4.5]decan-3-yl]methanone
- 3,4-dihydro-1H-isoquinolin-2-yl-[5-[(4-methoxynaphthalen-1-yl)oxymethyl]-1,2-oxazol-3-yl]methanone
- (3R)-4-(3-methylbut-2-enyl)-3-[2-(1,2-oxazinan-2-yl)-2-oxidanylidene-ethyl]piperazin-4-ium-2-one
- cyclohexyl-[(2R)-3-[2-methoxy-4-[[methyl-[2-(1-methylpyrazol-4-yl)ethyl]azaniumyl]methyl]phenoxy]-2-oxidanyl-propyl]-methyl-azanium
- ethyl 4-(2-methoxyethyl)-1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-carboxylate
- ethyl 4-(2-methoxyethyl)-1-[(1-methylpyrazol-4-yl)methyl]piperidine-4-carboxylate
- 2-(2-fluorophenyl)-N-[2-[(2-methyl-1,3-thiazol-5-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]ethanamide
- 7-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-3-methyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one
- N-methyl-N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]-2-[5-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,2,3,4-tetrazol-1-yl]ethanamide
- 2-(2-fluorophenyl)-N-[2-[(2-methyl-1,3-thiazol-5-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]ethanamide
