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MOLECULAR FORMULA: C15H21NO
MOLECULAR WEIGHT: 231.33334
SMILES: CC1[C@H]2C3=C(C[C@]1(CCN2C)C)C=C(C=C3)O
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MOLECULAR FORMULA: C18H25NO
MOLECULAR WEIGHT: 271.3972
SMILES: CC1[C@@H]2CC3=C([C@@]1(CCN2CC4CC4)C)C=C(C=C3)O
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MOLECULAR FORMULA: C17H23NO
MOLECULAR WEIGHT: 257.37062
SMILES: CC1[C@@H]2C3=C(C[C@]1(CCN2CC=C)C)C=C(C=C3)O
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MOLECULAR FORMULA: C21H25NO
MOLECULAR WEIGHT: 307.4293
SMILES: CC1[C@@H]2C3=C(C[C@]1(CCN2CC4=CC=CC=C4)C)C=C(C=C3)O
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MOLECULAR FORMULA: C19H27NO
MOLECULAR WEIGHT: 285.42378
SMILES: CC1[C@H]2C3=C(C[C@]1(CCN2CC=C(C)C)C)C=C(C=C3)O
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MOLECULAR FORMULA: C13H11ClN6
MOLECULAR WEIGHT: 286.71964
SMILES: CC1([C@@H]2[C@@H](C(=NN3C2=NN=C3)Cl)N=N1)C4=CC=CC=C4
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MOLECULAR FORMULA: C12H10ClN7
MOLECULAR WEIGHT: 287.7077
SMILES: CC1([C@@H]2[C@@H](C(=NN3C2=NN=N3)Cl)N=N1)C4=CC=CC=C4
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MOLECULAR FORMULA: C13H11ClN6
MOLECULAR WEIGHT: 286.71964
SMILES: C[C@]1([C@@H]2C(=NN1)C(=NN3C2=NN=C3)Cl)C4=CC=CC=C4
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MOLECULAR FORMULA: C12H10ClN7
MOLECULAR WEIGHT: 287.7077
SMILES: C[C@]1([C@@H]2C(=NN1)C(=NN3C2=NN=N3)Cl)C4=CC=CC=C4
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Product OPENEYE NAME: 2-bromo-3-fluoro-benzoyl chloride
CAS Name: 2-bromo-3-fluorobenzoyl chloride
IUPAC NAME: 2-bromo-3-fluorobenzoyl chloride
SYSTEMATIC NAME: 2-bromanyl-3-fluoranyl-benzoyl chloride
MOLECULAR FORMULA: C7H3BrClFO
MOLECULAR WEIGHT: 237.453523
SMILES: C1=CC(=C(C(=C1)F)Br)C(=O)Cl
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Product OPENEYE NAME: 3-(2-fluoro-6-nitro-phenyl)propanoyl chloride
CAS Name: 3-(2-fluoro-6-nitrophenyl)propanoyl chloride
IUPAC NAME: 3-(2-fluoro-6-nitrophenyl)propanoyl chloride
SYSTEMATIC NAME: 3-(2-fluoranyl-6-nitro-phenyl)propanoyl chloride
MOLECULAR FORMULA: C9H7ClFNO3
MOLECULAR WEIGHT: 231.608183
SMILES: C1=CC(=C(C(=C1)F)CCC(=O)Cl)[N+](=O)[O-]
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Product OPENEYE NAME: 3-[2-fluoro-6-[(2E)-2-(4-hydroxybutylidene)hydrazino]phenyl]-N,N-dimethyl-propanamide
CAS Name: 3-[2-fluoro-6-[(2E)-2-(4-hydroxybutylidene)hydrazinyl]phenyl]-N,N-dimethylpropanamide
IUPAC NAME: 3-[2-fluoro-6-[(2E)-2-(4-hydroxybutylidene)hydrazinyl]phenyl]-N,N-dimethylpropanamide
SYSTEMATIC NAME: 3-[2-fluoranyl-6-[(2E)-2-(4-oxidanylbutylidene)hydrazinyl]phenyl]-N,N-dimethyl-propanamide
MOLECULAR FORMULA: C15H22FN3O2
MOLECULAR WEIGHT: 295.352483
SMILES: CN(C)C(=O)CCC1=C(C=CC=C1F)N/N=C/CCCO
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Product OPENEYE NAME: diethyl 2-[(2-fluoro-6-nitro-phenyl)methyl]propanedioate
CAS Name: 2-[(2-fluoro-6-nitrophenyl)methyl]propanedioic acid diethyl ester
IUPAC NAME: diethyl 2-[(2-fluoro-6-nitrophenyl)methyl]propanedioate
SYSTEMATIC NAME: diethyl 2-[(2-fluoranyl-6-nitro-phenyl)methyl]propanedioate
MOLECULAR FORMULA: C14H16FNO6
MOLECULAR WEIGHT: 313.278343
SMILES: CCOC(=O)C(CC1=C(C=CC=C1F)[N+](=O)[O-])C(=O)OCC
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Product OPENEYE NAME: (4E)-4-[[2-(2-benzyloxyethyl)-3-fluoro-phenyl]hydrazono]butan-1-ol
CAS Name: (4E)-4-[[3-fluoro-2-(2-phenylmethoxyethyl)phenyl]hydrazinylidene]-1-butanol
IUPAC NAME: (4E)-4-[[3-fluoro-2-(2-phenylmethoxyethyl)phenyl]hydrazinylidene]butan-1-ol
SYSTEMATIC NAME: (4E)-4-[[3-fluoranyl-2-(2-phenylmethoxyethyl)phenyl]hydrazinylidene]butan-1-ol
MOLECULAR FORMULA: C19H23FN2O2
MOLECULAR WEIGHT: 330.396523
SMILES: C1=CC=C(C=C1)COCCC2=C(C=CC=C2F)N/N=C/CCCO
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Product OPENEYE NAME: methyl 2-[8-(2-benzyloxyethyl)-1-ethyl-7-fluoro-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetate
CAS Name: 2-[1-ethyl-7-fluoro-8-(2-phenylmethoxyethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid methyl ester
IUPAC NAME: methyl 2-[1-ethyl-7-fluoro-8-(2-phenylmethoxyethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetate
SYSTEMATIC NAME: methyl 2-[1-ethyl-7-fluoranyl-8-(2-phenylmethoxyethyl)-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]ethanoate
MOLECULAR FORMULA: C25H28FNO4
MOLECULAR WEIGHT: 425.492523
SMILES: CCC1(C2=C(CCO1)C3=C(N2)C(=C(C=C3)F)CCOCC4=CC=CC=C4)CC(=O)OC
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Product OPENEYE NAME: 3-(2-fluoro-6-hydrazino-phenyl)-N,N-dimethyl-propanamide
CAS Name: 3-(2-fluoro-6-hydrazinylphenyl)-N,N-dimethylpropanamide
IUPAC NAME: 3-(2-fluoro-6-hydrazinylphenyl)-N,N-dimethylpropanamide
SYSTEMATIC NAME: 3-(2-diazanyl-6-fluoranyl-phenyl)-N,N-dimethyl-propanamide
MOLECULAR FORMULA: C11H16FN3O
MOLECULAR WEIGHT: 225.262643
SMILES: CN(C)C(=O)CCC1=C(C=CC=C1F)NN
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Product OPENEYE NAME: [2-(2-benzyloxyethyl)-3-fluoro-phenyl]hydrazine
CAS Name: [3-fluoro-2-(2-phenylmethoxyethyl)phenyl]hydrazine
IUPAC NAME: [3-fluoro-2-(2-phenylmethoxyethyl)phenyl]hydrazine
SYSTEMATIC NAME: [3-fluoranyl-2-(2-phenylmethoxyethyl)phenyl]diazane
MOLECULAR FORMULA: C15H17FN2O
MOLECULAR WEIGHT: 260.306683
SMILES: C1=CC=C(C=C1)COCCC2=C(C=CC=C2F)NN
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Product OPENEYE NAME: 2-(1-ethyl-7-fluoro-8-sulfanyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid
CAS Name: 2-(1-ethyl-7-fluoro-8-mercapto-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid
IUPAC NAME: 2-(1-ethyl-7-fluoro-8-sulfanyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid
SYSTEMATIC NAME: 2-(1-ethyl-7-fluoranyl-8-sulfanyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)ethanoic acid
MOLECULAR FORMULA: C15H16FNO3S
MOLECULAR WEIGHT: 309.355843
SMILES: CCC1(C2=C(CCO1)C3=C(N2)C(=C(C=C3)F)S)CC(=O)O
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Product OPENEYE NAME: 2,4-ditert-butoxy-5-[(Z)-prop-1-enyl]pyrimidine
CAS Name: 2,4-bis[(2-methylpropan-2-yl)oxy]-5-[(Z)-prop-1-enyl]pyrimidine
IUPAC NAME: 2,4-bis[(2-methylpropan-2-yl)oxy]-5-[(Z)-prop-1-enyl]pyrimidine
SYSTEMATIC NAME: 2,4-bis[(2-methylpropan-2-yl)oxy]-5-[(Z)-prop-1-enyl]pyrimidine
MOLECULAR FORMULA: C15H24N2O2
MOLECULAR WEIGHT: 264.36326
SMILES: C/C=C\C1=CN=C(N=C1OC(C)(C)C)OC(C)(C)C
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Product OPENEYE NAME: 6,7-bis(dodecylsulfanyl)-3-imino-benzo[f]isoindol-1-amine
CAS Name: 6,7-bis(dodecylthio)-3-imino-1-benzo[f]isoindolamine
IUPAC NAME: 6,7-bis(dodecylsulfanyl)-3-iminobenzo[f]isoindol-1-amine
SYSTEMATIC NAME: 3-azanylidene-6,7-bis(dodecylsulfanyl)benzo[f]isoindol-1-amine
MOLECULAR FORMULA: C36H57N3S2
MOLECULAR WEIGHT: 595.98788
SMILES: CCCCCCCCCCCCSC1=CC2=CC3=C(C=C2C=C1SCCCCCCCCCCCC)C(=N)N=C3N
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