Product OPENEYE NAME: 3,5-dimethylmorpholine
CAS Name: 3,5-dimethylmorpholine
IUPAC NAME: 3,5-dimethylmorpholine
SYSTEMATIC NAME: 3,5-dimethylmorpholine
MOLECULAR FORMULA: C6H13NO
MOLECULAR WEIGHT: 115.17352
SMILES: CC1COCC(N1)C
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Product OPENEYE NAME: 8,8-dimethoxy-2,6-dimethyl-octan-2-ol
CAS Name: 8,8-dimethoxy-2,6-dimethyl-2-octanol
IUPAC NAME: 8,8-dimethoxy-2,6-dimethyloctan-2-ol
SYSTEMATIC NAME: 8,8-dimethoxy-2,6-dimethyl-octan-2-ol
MOLECULAR FORMULA: C12H26O3
MOLECULAR WEIGHT: 218.33304
SMILES: CC(CCCC(C)(C)O)CC(OC)OC
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Product OPENEYE NAME: 1,3-diethylbenzene
CAS Name: 1,3-diethylbenzene
IUPAC NAME: 1,3-diethylbenzene
SYSTEMATIC NAME: 1,3-diethylbenzene
MOLECULAR FORMULA: C10H14
MOLECULAR WEIGHT: 134.21816
SMILES: CCC1=CC(=CC=C1)CC
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Product OPENEYE NAME: disodium propanedioate
CAS Name: disodium propanedioate
IUPAC NAME: disodium propanedioate
SYSTEMATIC NAME: disodium propanedioate
MOLECULAR FORMULA: C3H2Na2O4
MOLECULAR WEIGHT: 148.02512
SMILES: C(C(=O)[O-])C(=O)[O-].[Na+].[Na+]
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Product OPENEYE NAME: sec-butoxymethanedithioic acid
CAS Name: butan-2-yloxymethanedithioic acid
IUPAC NAME: butan-2-yloxymethanedithioic acid
SYSTEMATIC NAME: butan-2-yloxymethanedithioic acid
MOLECULAR FORMULA: C5H10OS2
MOLECULAR WEIGHT: 150.2623
SMILES: CCC(C)OC(=S)S
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Product OPENEYE NAME: ethyl 3-oxobutanoate
CAS Name: 3-oxobutanoic acid ethyl ester
IUPAC NAME: ethyl 3-oxobutanoate
SYSTEMATIC NAME: ethyl 3-oxidanylidenebutanoate
MOLECULAR FORMULA: C6H10O3
MOLECULAR WEIGHT: 130.1418
SMILES: CCOC(=O)CC(=O)C
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Product OPENEYE NAME: aniline hydrochloride
CAS Name: aniline hydrochloride
IUPAC NAME: aniline hydrochloride
SYSTEMATIC NAME: aniline hydrochloride
MOLECULAR FORMULA: C6H8ClN
MOLECULAR WEIGHT: 129.58742
SMILES: C1=CC=C(C=C1)N.Cl
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Product OPENEYE NAME: 1H-pyridin-2-one
CAS Name: 1H-pyridin-2-one
IUPAC NAME: 1H-pyridin-2-one
SYSTEMATIC NAME: 1H-pyridin-2-one
MOLECULAR FORMULA: C5H5NO
MOLECULAR WEIGHT: 95.0993
SMILES: C1=CC(=O)NC=C1
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Product OPENEYE NAME: hexyl 2-methylprop-2-enoate
CAS Name: 2-methyl-2-propenoic acid hexyl ester
IUPAC NAME: hexyl 2-methylprop-2-enoate
SYSTEMATIC NAME: hexyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C10H18O2
MOLECULAR WEIGHT: 170.24872
SMILES: CCCCCCOC(=O)C(=C)C
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Product OPENEYE NAME: bis(2-ethylhexyl) but-2-enedioate
CAS Name: 2-butenedioic acid bis(2-ethylhexyl) ester
IUPAC NAME: bis(2-ethylhexyl) but-2-enedioate
SYSTEMATIC NAME: bis(2-ethylhexyl) but-2-enedioate
MOLECULAR FORMULA: C20H36O4
MOLECULAR WEIGHT: 340.49744
SMILES: CCCCC(CC)COC(=O)C=CC(=O)OCC(CC)CCCC
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Product OPENEYE NAME: calcium octadec-9-enoate
CAS Name: calcium 9-octadecenoate
IUPAC NAME: calcium octadec-9-enoate
SYSTEMATIC NAME: calcium octadec-9-enoate
MOLECULAR FORMULA: C36H66CaO4
MOLECULAR WEIGHT: 602.98484
SMILES: CCCCCCCCC=CCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-].[Ca+2]
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Product OPENEYE NAME: allyl heptanoate
CAS Name: heptanoic acid prop-2-enyl ester
IUPAC NAME: prop-2-enyl heptanoate
SYSTEMATIC NAME: prop-2-enyl heptanoate
MOLECULAR FORMULA: C10H18O2
MOLECULAR WEIGHT: 170.24872
SMILES: CCCCCCC(=O)OCC=C
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Product OPENEYE NAME: allyl 2-(2-allyloxycarbonyloxyethoxy)ethyl carbonate
CAS Name: carbonic acid 2-[2-[oxo(prop-2-enoxy)methoxy]ethoxy]ethyl prop-2-enyl ester
IUPAC NAME: 2-(2-prop-2-enoxycarbonyloxyethoxy)ethyl prop-2-enyl carbonate
SYSTEMATIC NAME: 2-(2-prop-2-enoxycarbonyloxyethoxy)ethyl prop-2-enyl carbonate
MOLECULAR FORMULA: C12H18O7
MOLECULAR WEIGHT: 274.26712
SMILES: C=CCOC(=O)OCCOCCOC(=O)OCC=C
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Product OPENEYE NAME: N-(2-hydroxyethyl)acetamide
CAS Name: N-(2-hydroxyethyl)acetamide
IUPAC NAME: N-(2-hydroxyethyl)acetamide
SYSTEMATIC NAME: N-(2-hydroxyethyl)ethanamide
MOLECULAR FORMULA: C4H9NO2
MOLECULAR WEIGHT: 103.11976
SMILES: CC(=O)NCCO
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Product OPENEYE NAME: 1,3-dichloropropane
CAS Name: 1,3-dichloropropane
IUPAC NAME: 1,3-dichloropropane
SYSTEMATIC NAME: 1,3-bis(chloranyl)propane
MOLECULAR FORMULA: C3H6Cl2
MOLECULAR WEIGHT: 112.98574
SMILES: C(CCl)CCl
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Product OPENEYE NAME: cyclopentene
CAS Name: cyclopentene
IUPAC NAME: cyclopentene
SYSTEMATIC NAME: cyclopentene
MOLECULAR FORMULA: C5H8
MOLECULAR WEIGHT: 68.11702
SMILES: C1CC=CC1
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Product OPENEYE NAME: 2,5-dimethylhex-3-yne-2,5-diol
CAS Name: 2,5-dimethyl-3-hexyne-2,5-diol
IUPAC NAME: 2,5-dimethylhex-3-yne-2,5-diol
SYSTEMATIC NAME: 2,5-dimethylhex-3-yne-2,5-diol
MOLECULAR FORMULA: C8H14O2
MOLECULAR WEIGHT: 142.19556
SMILES: CC(C)(C#CC(C)(C)O)O
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Product OPENEYE NAME: octyl hydrogen sulfate
CAS Name: sulfuric acid octyl ester
IUPAC NAME: octyl hydrogen sulfate
SYSTEMATIC NAME: octyl hydrogen sulfate
MOLECULAR FORMULA: C8H18O4S
MOLECULAR WEIGHT: 210.29112
SMILES: CCCCCCCCOS(=O)(=O)O
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Product OPENEYE NAME: 3,7,11-trimethyldodeca-1,6,10-trien-3-ol
CAS Name: 3,7,11-trimethyl-3-dodeca-1,6,10-trienol
IUPAC NAME: 3,7,11-trimethyldodeca-1,6,10-trien-3-ol
SYSTEMATIC NAME: 3,7,11-trimethyldodeca-1,6,10-trien-3-ol
MOLECULAR FORMULA: C15H26O
MOLECULAR WEIGHT: 222.36634
SMILES: CC(=CCCC(=CCCC(C)(C=C)O)C)C
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Product OPENEYE NAME: N-(1-hydroxy-1-methyl-ethyl)dodecanamide
CAS Name: N-(2-hydroxypropan-2-yl)dodecanamide
IUPAC NAME: N-(2-hydroxypropan-2-yl)dodecanamide
SYSTEMATIC NAME: N-(2-oxidanylpropan-2-yl)dodecanamide
MOLECULAR FORMULA: C15H31NO2
MOLECULAR WEIGHT: 257.41214
SMILES: CCCCCCCCCCCC(=O)NC(C)(C)O
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