Product OPENEYE NAME: 4-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl-4-methyl-pentan-2-one
CAS Name: 4-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]-4-methyl-2-pentanone
IUPAC NAME: 4-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanyl-4-methylpentan-2-one
SYSTEMATIC NAME: 4-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-4-methyl-pentan-2-one
MOLECULAR FORMULA: C20H32O2S
MOLECULAR WEIGHT: 336.53188
SMILES: CC(=O)CC(C)(C)SC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C
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Product OPENEYE NAME: 4-[3,3-bis[(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl]-1,1-dimethyl-butyl]sulfanyl-2,6-ditert-butyl-phenol
CAS Name: 4-[[4,4-bis[(3,5-ditert-butyl-4-hydroxyphenyl)thio]-2-methylpentan-2-yl]thio]-2,6-ditert-butylphenol
IUPAC NAME: 4-[4,4-bis[(3,5-ditert-butyl-4-hydroxyphenyl)sulfanyl]-2-methylpentan-2-yl]sulfanyl-2,6-ditert-butylphenol
SYSTEMATIC NAME: 4-[4,4-bis[(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl]-2-methyl-pentan-2-yl]sulfanyl-2,6-ditert-butyl-phenol
MOLECULAR FORMULA: C48H74O3S3
MOLECULAR WEIGHT: 795.29436
SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC(C)(C)CC(C)(SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)SC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C
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Product OPENEYE NAME: 3-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)sulfanylbutanal
CAS Name: 3-[(3-tert-butyl-4-hydroxy-5-methylphenyl)thio]butanal
IUPAC NAME: 3-(3-tert-butyl-4-hydroxy-5-methylphenyl)sulfanylbutanal
SYSTEMATIC NAME: 3-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)sulfanylbutanal
MOLECULAR FORMULA: C15H22O2S
MOLECULAR WEIGHT: 266.39898
SMILES: CC1=CC(=CC(=C1O)C(C)(C)C)SC(C)CC=O
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Product OPENEYE NAME: 4-[3,3-bis[(3-tert-butyl-4-hydroxy-5-methyl-phenyl)sulfanyl]-1-methyl-propyl]sulfanyl-2-tert-butyl-6-methyl-phenol
CAS Name: 4-[4,4-bis[(3-tert-butyl-4-hydroxy-5-methylphenyl)thio]butan-2-ylthio]-2-tert-butyl-6-methylphenol
IUPAC NAME: 4-[4,4-bis[(3-tert-butyl-4-hydroxy-5-methylphenyl)sulfanyl]butan-2-ylsulfanyl]-2-tert-butyl-6-methylphenol
SYSTEMATIC NAME: 4-[4,4-bis[(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)sulfanyl]butan-2-ylsulfanyl]-2-tert-butyl-6-methyl-phenol
MOLECULAR FORMULA: C37H52O3S3
MOLECULAR WEIGHT: 641.00198
SMILES: CC1=CC(=CC(=C1O)C(C)(C)C)SC(C)CC(SC2=CC(=C(C(=C2)C)O)C(C)(C)C)SC3=CC(=C(C(=C3)C)O)C(C)(C)C
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Product OPENEYE NAME: 3,5-bis[(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl]hexanal
CAS Name: 3,5-bis[(3,5-ditert-butyl-4-hydroxyphenyl)thio]hexanal
IUPAC NAME: 3,5-bis[(3,5-ditert-butyl-4-hydroxyphenyl)sulfanyl]hexanal
SYSTEMATIC NAME: 3,5-bis[(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl]hexanal
MOLECULAR FORMULA: C34H52O3S2
MOLECULAR WEIGHT: 572.90488
SMILES: CC(CC(CC=O)SC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C
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Product OPENEYE NAME: 2,6-ditert-butyl-4-[3,5,5-tris[(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl]-1-methyl-pentyl]sulfanyl-phenol
CAS Name: 2,6-ditert-butyl-4-[4,6,6-tris[(3,5-ditert-butyl-4-hydroxyphenyl)thio]hexan-2-ylthio]phenol
IUPAC NAME: 2,6-ditert-butyl-4-[4,6,6-tris[(3,5-ditert-butyl-4-hydroxyphenyl)sulfanyl]hexan-2-ylsulfanyl]phenol
SYSTEMATIC NAME: 2,6-ditert-butyl-4-[4,6,6-tris[(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl]hexan-2-ylsulfanyl]phenol
MOLECULAR FORMULA: C62H94O4S4
MOLECULAR WEIGHT: 1031.66736
SMILES: CC(CC(CC(SC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)SC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)SC4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C
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Product OPENEYE NAME: 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]-2,6-dimethyl-phenol
CAS Name: 4-[2-(4-hydroxyphenyl)propan-2-yl]-2,6-dimethylphenol
IUPAC NAME: 4-[2-(4-hydroxyphenyl)propan-2-yl]-2,6-dimethylphenol
SYSTEMATIC NAME: 4-[2-(4-hydroxyphenyl)propan-2-yl]-2,6-dimethyl-phenol
MOLECULAR FORMULA: C17H20O2
MOLECULAR WEIGHT: 256.3395
SMILES: CC1=CC(=CC(=C1O)C)C(C)(C)C2=CC=C(C=C2)O
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Product OPENEYE NAME: [2-(diethylamino)phenyl]-phenyl-methanone
CAS Name: [2-(diethylamino)phenyl]-phenylmethanone
IUPAC NAME: [2-(diethylamino)phenyl]-phenylmethanone
SYSTEMATIC NAME: [2-(diethylamino)phenyl]-phenyl-methanone
MOLECULAR FORMULA: C17H19NO
MOLECULAR WEIGHT: 253.33886
SMILES: CCN(CC)C1=CC=CC=C1C(=O)C2=CC=CC=C2
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Product OPENEYE NAME: (4Z)-4-[(E)-3-[5-carboxy-2-(2,5-disulfophenyl)-3-oxo-1H-pyrazol-4-yl]prop-2-enylidene]-1-(2,5-disulfophenyl)-5-oxo-pyrazole-3-carboxylic acid
CAS Name: (4Z)-4-[(E)-3-[5-carboxy-2-(2,5-disulfophenyl)-3-oxo-1H-pyrazol-4-yl]prop-2-enylidene]-1-(2,5-disulfophenyl)-5-oxo-3-pyrazolecarboxylic acid
IUPAC NAME: (4Z)-4-[(E)-3-[5-carboxy-2-(2,5-disulfophenyl)-3-oxo-1H-pyrazol-4-yl]prop-2-enylidene]-1-(2,5-disulfophenyl)-5-oxopyrazole-3-carboxylic acid
SYSTEMATIC NAME: (4Z)-4-[(E)-3-[5-carboxy-2-(2,5-disulfophenyl)-3-oxidanylidene-1H-pyrazol-4-yl]prop-2-enylidene]-1-(2,5-disulfophenyl)-5-oxidanylidene-pyrazole-3-carboxylic acid
MOLECULAR FORMULA: C23H16N4O18S4
MOLECULAR WEIGHT: 764.64914
SMILES: C1=CC(=C(C=C1S(=O)(=O)O)N2C(=O)C(=C(N2)C(=O)O)/C=C/C=C\3/C(=NN(C3=O)C4=C(C=CC(=C4)S(=O)(=O)O)S(=O)(=O)O)C(=O)O)S(=O)(=O)O
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Product OPENEYE NAME: nickelic triacetate
CAS Name: nickel(3+) triacetate
IUPAC NAME: nickel(3+) triacetate
SYSTEMATIC NAME: nickel(3+) triethanoate
MOLECULAR FORMULA: C6H9NiO6
MOLECULAR WEIGHT: 235.82546
SMILES: CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Ni+3]
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Product OPENEYE NAME: (1-hydroperoxy-2-phenyl-ethyl)benzene
CAS Name: (1-hydroperoxy-2-phenylethyl)benzene
IUPAC NAME: (1-hydroperoxy-2-phenylethyl)benzene
SYSTEMATIC NAME: [1-(dioxidanyl)-2-phenyl-ethyl]benzene
MOLECULAR FORMULA: C14H14O2
MOLECULAR WEIGHT: 214.25976
SMILES: C1=CC=C(C=C1)CC(C2=CC=CC=C2)OO
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Product OPENEYE NAME: 3-trimethylsilylpropyl 2-methylprop-2-enoate
CAS Name: 2-methyl-2-propenoic acid 3-trimethylsilylpropyl ester
IUPAC NAME: 3-trimethylsilylpropyl 2-methylprop-2-enoate
SYSTEMATIC NAME: 3-trimethylsilylpropyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C10H20O2Si
MOLECULAR WEIGHT: 200.3501
SMILES: CC(=C)C(=O)OCCC[Si](C)(C)C
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Product OPENEYE NAME: methyl oxiran-2-ylmethyl carbonate
CAS Name: carbonic acid methyl 2-oxiranylmethyl ester
IUPAC NAME: methyl oxiran-2-ylmethyl carbonate
SYSTEMATIC NAME: methyl oxiran-2-ylmethyl carbonate
MOLECULAR FORMULA: C5H8O4
MOLECULAR WEIGHT: 132.11462
SMILES: COC(=O)OCC1CO1
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Product OPENEYE NAME: 2-(2-chloro-5-ethyl-phenyl)ethanamine
CAS Name: 2-(2-chloro-5-ethylphenyl)ethanamine
IUPAC NAME: 2-(2-chloro-5-ethylphenyl)ethanamine
SYSTEMATIC NAME: 2-(2-chloranyl-5-ethyl-phenyl)ethanamine
MOLECULAR FORMULA: C10H14ClN
MOLECULAR WEIGHT: 183.67786
SMILES: CCC1=CC(=C(C=C1)Cl)CCN
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Product OPENEYE NAME: 2-(2-bromo-5-butyl-phenyl)ethanamine
CAS Name: 2-(2-bromo-5-butylphenyl)ethanamine
IUPAC NAME: 2-(2-bromo-5-butylphenyl)ethanamine
SYSTEMATIC NAME: 2-(2-bromanyl-5-butyl-phenyl)ethanamine
MOLECULAR FORMULA: C12H18BrN
MOLECULAR WEIGHT: 256.18202
SMILES: CCCCC1=CC(=C(C=C1)Br)CCN
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Product OPENEYE NAME: 2-(2-bromo-4-isopropoxy-5-nitro-phenyl)ethanamine
CAS Name: 2-(2-bromo-5-nitro-4-propan-2-yloxyphenyl)ethanamine
IUPAC NAME: 2-(2-bromo-5-nitro-4-propan-2-yloxyphenyl)ethanamine
SYSTEMATIC NAME: 2-(2-bromanyl-5-nitro-4-propan-2-yloxy-phenyl)ethanamine
MOLECULAR FORMULA: C11H15BrN2O3
MOLECULAR WEIGHT: 303.1524
SMILES: CC(C)OC1=C(C=C(C(=C1)Br)CCN)[N+](=O)[O-]
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Product OPENEYE NAME: 2-(2-chloro-4-methoxy-phenyl)ethanamine
CAS Name: 2-(2-chloro-4-methoxyphenyl)ethanamine
IUPAC NAME: 2-(2-chloro-4-methoxyphenyl)ethanamine
SYSTEMATIC NAME: 2-(2-chloranyl-4-methoxy-phenyl)ethanamine
MOLECULAR FORMULA: C9H12ClNO
MOLECULAR WEIGHT: 185.65068
SMILES: COC1=CC(=C(C=C1)CCN)Cl
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Product OPENEYE NAME: 2-(2-chloro-5-nitro-phenyl)ethanamine
CAS Name: 2-(2-chloro-5-nitrophenyl)ethanamine
IUPAC NAME: 2-(2-chloro-5-nitrophenyl)ethanamine
SYSTEMATIC NAME: 2-(2-chloranyl-5-nitro-phenyl)ethanamine
MOLECULAR FORMULA: C8H9ClN2O2
MOLECULAR WEIGHT: 200.62226
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])CCN)Cl
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Product OPENEYE NAME: 4-(2-aminoethyl)-3-fluoro-phenol
CAS Name: 4-(2-aminoethyl)-3-fluorophenol
IUPAC NAME: 4-(2-aminoethyl)-3-fluorophenol
SYSTEMATIC NAME: 4-(2-azanylethyl)-3-fluoranyl-phenol
MOLECULAR FORMULA: C8H10FNO
MOLECULAR WEIGHT: 155.169503
SMILES: C1=CC(=C(C=C1O)F)CCN
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Product OPENEYE NAME: 2-(2-bromophenyl)butan-1-amine
CAS Name: 2-(2-bromophenyl)-1-butanamine
IUPAC NAME: 2-(2-bromophenyl)butan-1-amine
SYSTEMATIC NAME: 2-(2-bromophenyl)butan-1-amine
MOLECULAR FORMULA: C10H14BrN
MOLECULAR WEIGHT: 228.12886
SMILES: CCC(CN)C1=CC=CC=C1Br
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Product OPENEYE NAME: 2-(2-chlorophenyl)hexan-1-amine
CAS Name: 2-(2-chlorophenyl)-1-hexanamine
IUPAC NAME: 2-(2-chlorophenyl)hexan-1-amine
SYSTEMATIC NAME: 2-(2-chlorophenyl)hexan-1-amine
MOLECULAR FORMULA: C12H18ClN
MOLECULAR WEIGHT: 211.73102
SMILES: CCCCC(CN)C1=CC=CC=C1Cl
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Product OPENEYE NAME: 4,5-dimethoxyindoline
CAS Name: 4,5-dimethoxy-2,3-dihydro-1H-indole
IUPAC NAME: 4,5-dimethoxy-2,3-dihydro-1H-indole
SYSTEMATIC NAME: 4,5-dimethoxy-2,3-dihydro-1H-indole
MOLECULAR FORMULA: C10H13NO2
MOLECULAR WEIGHT: 179.21572
SMILES: COC1=C(C2=C(C=C1)NCC2)OC
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Product OPENEYE NAME: 3-butylindoline
CAS Name: 3-butyl-2,3-dihydro-1H-indole
IUPAC NAME: 3-butyl-2,3-dihydro-1H-indole
SYSTEMATIC NAME: 3-butyl-2,3-dihydro-1H-indole
MOLECULAR FORMULA: C12H17N
MOLECULAR WEIGHT: 175.27008
SMILES: CCCCC1CNC2=CC=CC=C12
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Product OPENEYE NAME: 3-ethyl-2,5-dimethyl-1,3-benzotellurazol-3-ium
CAS Name: 3-ethyl-2,5-dimethyl-1,3-benzotellurazol-3-ium
IUPAC NAME: 3-ethyl-2,5-dimethyl-1,3-benzotellurazol-3-ium
SYSTEMATIC NAME: 3-ethyl-2,5-dimethyl-1,3-benzotellurazol-3-ium
MOLECULAR FORMULA: C11H14NTe+
MOLECULAR WEIGHT: 287.83556
SMILES: CC[N+]1=C([Te]C2=C1C=C(C=C2)C)C
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