Product OPENEYE NAME: tridecyl prop-2-enoate
CAS Name: 2-propenoic acid tridecyl ester
IUPAC NAME: tridecyl prop-2-enoate
SYSTEMATIC NAME: tridecyl prop-2-enoate
MOLECULAR FORMULA: C16H30O2
MOLECULAR WEIGHT: 254.4082
SMILES: CCCCCCCCCCCCCOC(=O)C=C
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Product OPENEYE NAME: 1-methoxy-1-oxo-octadecane-2-sulfonic acid
CAS Name: 1-methoxy-1-oxo-2-octadecanesulfonic acid
IUPAC NAME: 1-methoxy-1-oxooctadecane-2-sulfonic acid
SYSTEMATIC NAME: 1-methoxy-1-oxidanylidene-octadecane-2-sulfonic acid
MOLECULAR FORMULA: C19H38O5S
MOLECULAR WEIGHT: 378.56702
SMILES: CCCCCCCCCCCCCCCCC(C(=O)OC)S(=O)(=O)O
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Product OPENEYE NAME: 1-methylsulfinyldodecane
CAS Name: 1-methylsulfinyldodecane
IUPAC NAME: 1-methylsulfinyldodecane
SYSTEMATIC NAME: 1-methylsulfinyldodecane
MOLECULAR FORMULA: C13H28OS
MOLECULAR WEIGHT: 232.42582
SMILES: CCCCCCCCCCCCS(=O)C
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Product OPENEYE NAME: N1,N4-bis(1,4-dimethylpentyl)benzene-1,4-diamine
CAS Name: N1,N4-bis(5-methylhexan-2-yl)benzene-1,4-diamine
IUPAC NAME: 1-N,4-N-bis(5-methylhexan-2-yl)benzene-1,4-diamine
SYSTEMATIC NAME: N1,N4-bis(5-methylhexan-2-yl)benzene-1,4-diamine
MOLECULAR FORMULA: C20H36N2
MOLECULAR WEIGHT: 304.51324
SMILES: CC(C)CCC(C)NC1=CC=C(C=C1)NC(C)CCC(C)C
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Product OPENEYE NAME: 2-(trichloromethyl)oxirane
CAS Name: 2-(trichloromethyl)oxirane
IUPAC NAME: 2-(trichloromethyl)oxirane
SYSTEMATIC NAME: 2-(trichloromethyl)oxirane
MOLECULAR FORMULA: C3H3Cl3O
MOLECULAR WEIGHT: 161.41432
SMILES: C1C(O1)C(Cl)(Cl)Cl
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Product OPENEYE NAME: 2-(2,2,2-trichloroethyl)oxirane
CAS Name: 2-(2,2,2-trichloroethyl)oxirane
IUPAC NAME: 2-(2,2,2-trichloroethyl)oxirane
SYSTEMATIC NAME: 2-[2,2,2-tris(chloranyl)ethyl]oxirane
MOLECULAR FORMULA: C4H5Cl3O
MOLECULAR WEIGHT: 175.4409
SMILES: C1C(O1)CC(Cl)(Cl)Cl
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Product OPENEYE NAME: 1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
CAS Name: 1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]pyrimidine-2,4-dione
IUPAC NAME: 1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[(2R,3S,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]pyrimidine-2,4-dione
MOLECULAR FORMULA: C9H12N2O6
MOLECULAR WEIGHT: 244.20138
SMILES: C1=CN(C(=O)NC1=O)[C@H]2[C@H]([C@@H]([C@H](O2)CO)O)O
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Product OPENEYE NAME: 2-butoxypropyl 2-(2,4,5-trichlorophenoxy)acetate
CAS Name: 2-(2,4,5-trichlorophenoxy)acetic acid 2-butoxypropyl ester
IUPAC NAME: 2-butoxypropyl 2-(2,4,5-trichlorophenoxy)acetate
SYSTEMATIC NAME: 2-butoxypropyl 2-[2,4,5-tris(chloranyl)phenoxy]ethanoate
MOLECULAR FORMULA: C15H19Cl3O4
MOLECULAR WEIGHT: 369.66796
SMILES: CCCCOC(C)COC(=O)COC1=CC(=C(C=C1Cl)Cl)Cl
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Product OPENEYE NAME: 6-chloro-N2-ethyl-N4-methyl-1,3,5-triazine-2,4-diamine
CAS Name: 6-chloro-N2-ethyl-N4-methyl-1,3,5-triazine-2,4-diamine
IUPAC NAME: 6-chloro-2-N-ethyl-4-N-methyl-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: 6-chloranyl-N2-ethyl-N4-methyl-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C6H10ClN5
MOLECULAR WEIGHT: 187.6301
SMILES: CCNC1=NC(=NC(=N1)NC)Cl
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Product OPENEYE NAME: 6-bromo-N2,N4-diethyl-1,3,5-triazine-2,4-diamine
CAS Name: 6-bromo-N2,N4-diethyl-1,3,5-triazine-2,4-diamine
IUPAC NAME: 6-bromo-2-N,4-N-diethyl-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: 6-bromanyl-N2,N4-diethyl-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C7H12BrN5
MOLECULAR WEIGHT: 246.10768
SMILES: CCNC1=NC(=NC(=N1)Br)NCC
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Product OPENEYE NAME: 1-isobutylsulfinyl-2-methyl-propane
CAS Name: 2-methyl-1-(2-methylpropylsulfinyl)propane
IUPAC NAME: 2-methyl-1-(2-methylpropylsulfinyl)propane
SYSTEMATIC NAME: 2-methyl-1-(2-methylpropylsulfinyl)propane
MOLECULAR FORMULA: C8H18OS
MOLECULAR WEIGHT: 162.29292
SMILES: CC(C)CS(=O)CC(C)C
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Product OPENEYE NAME: 1-chloro-4-(4-chlorophenyl)sulfinyl-benzene
CAS Name: 1-chloro-4-(4-chlorophenyl)sulfinylbenzene
IUPAC NAME: 1-chloro-4-(4-chlorophenyl)sulfinylbenzene
SYSTEMATIC NAME: 1-chloranyl-4-(4-chlorophenyl)sulfinyl-benzene
MOLECULAR FORMULA: C12H8Cl2OS
MOLECULAR WEIGHT: 271.16232
SMILES: C1=CC(=CC=C1S(=O)C2=CC=C(C=C2)Cl)Cl
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Product OPENEYE NAME: 2-(2-hydroxyethylsulfinyl)ethanol
CAS Name: 2-(2-hydroxyethylsulfinyl)ethanol
IUPAC NAME: 2-(2-hydroxyethylsulfinyl)ethanol
SYSTEMATIC NAME: 2-(2-hydroxyethylsulfinyl)ethanol
MOLECULAR FORMULA: C4H10O3S
MOLECULAR WEIGHT: 138.1854
SMILES: C(CS(=O)CCO)O
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Product OPENEYE NAME: N4-isopropyl-N4-phenyl-benzene-1,4-diamine
CAS Name: N4-phenyl-N4-propan-2-ylbenzene-1,4-diamine
IUPAC NAME: 4-N-phenyl-4-N-propan-2-ylbenzene-1,4-diamine
SYSTEMATIC NAME: N4-phenyl-N4-propan-2-yl-benzene-1,4-diamine
MOLECULAR FORMULA: C15H18N2
MOLECULAR WEIGHT: 226.31682
SMILES: CC(C)N(C1=CC=CC=C1)C2=CC=C(C=C2)N
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Product OPENEYE NAME: 3-[bis(2-chloroethyl)amino]benzoic acid
CAS Name: 3-[bis(2-chloroethyl)amino]benzoic acid
IUPAC NAME: 3-[bis(2-chloroethyl)amino]benzoic acid
SYSTEMATIC NAME: 3-[bis(2-chloroethyl)amino]benzoic acid
MOLECULAR FORMULA: C11H13Cl2NO2
MOLECULAR WEIGHT: 262.13242
SMILES: C1=CC(=CC(=C1)N(CCCl)CCCl)C(=O)O
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Product OPENEYE NAME: 2-[bis(2-chloroethyl)amino]benzoic acid
CAS Name: 2-[bis(2-chloroethyl)amino]benzoic acid
IUPAC NAME: 2-[bis(2-chloroethyl)amino]benzoic acid
SYSTEMATIC NAME: 2-[bis(2-chloroethyl)amino]benzoic acid
MOLECULAR FORMULA: C11H13Cl2NO2
MOLECULAR WEIGHT: 262.13242
SMILES: C1=CC=C(C(=C1)C(=O)O)N(CCCl)CCCl
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Product OPENEYE NAME: 3,4,5-trimethoxybenzamide
CAS Name: 3,4,5-trimethoxybenzamide
IUPAC NAME: 3,4,5-trimethoxybenzamide
SYSTEMATIC NAME: 3,4,5-trimethoxybenzamide
MOLECULAR FORMULA: C10H13NO4
MOLECULAR WEIGHT: 211.21452
SMILES: COC1=CC(=CC(=C1OC)OC)C(=O)N
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Product OPENEYE NAME: 2-(2-dodecoxyethoxy)ethyl hydrogen sulfate
CAS Name: sulfuric acid 2-(2-dodecoxyethoxy)ethyl ester
IUPAC NAME: 2-(2-dodecoxyethoxy)ethyl hydrogen sulfate
SYSTEMATIC NAME: 2-(2-dodecoxyethoxy)ethyl hydrogen sulfate
MOLECULAR FORMULA: C16H34O6S
MOLECULAR WEIGHT: 354.50256
SMILES: CCCCCCCCCCCCOCCOCCOS(=O)(=O)O
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Product OPENEYE NAME: 3-(1-piperidyl)propanenitrile
CAS Name: 3-(1-piperidinyl)propanenitrile
IUPAC NAME: 3-piperidin-1-ylpropanenitrile
SYSTEMATIC NAME: 3-piperidin-1-ylpropanenitrile
MOLECULAR FORMULA: C8H14N2
MOLECULAR WEIGHT: 138.21016
SMILES: C1CCN(CC1)CCC#N
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Product OPENEYE NAME: nonylboronic acid
CAS Name: nonylboronic acid
IUPAC NAME: nonylboronic acid
SYSTEMATIC NAME: nonylboronic acid
MOLECULAR FORMULA: C9H21BO2
MOLECULAR WEIGHT: 172.07284
SMILES: B(CCCCCCCCC)(O)O
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Product OPENEYE NAME: 2-amino-N-[2-(2,5-dimethoxyphenyl)-2-hydroxy-ethyl]acetamide hydrochloride
CAS Name: 2-amino-N-[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]acetamide hydrochloride
IUPAC NAME: 2-amino-N-[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]acetamide hydrochloride
SYSTEMATIC NAME: 2-azanyl-N-[2-(2,5-dimethoxyphenyl)-2-oxidanyl-ethyl]ethanamide hydrochloride
MOLECULAR FORMULA: C12H19ClN2O4
MOLECULAR WEIGHT: 290.74326
SMILES: COC1=CC(=C(C=C1)OC)C(CNC(=O)CN)O.Cl
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H32ClFO5
MOLECULAR WEIGHT: 454.959283
SMILES: CC1(O[C@@H]2C[C@H]3C4CCC5=CC(=O)CCC5([C@]4(C(CC3([C@@]2(O1)C(=O)CCl)C)O)F)C)C
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