Product OPENEYE NAME: 2-(isobutylamino)ethyl 4-aminobenzoate
CAS Name: 4-aminobenzoic acid 2-(2-methylpropylamino)ethyl ester
IUPAC NAME: 2-(2-methylpropylamino)ethyl 4-aminobenzoate
SYSTEMATIC NAME: 2-(2-methylpropylamino)ethyl 4-azanylbenzoate
MOLECULAR FORMULA: C13H20N2O2
MOLECULAR WEIGHT: 236.3101
SMILES: CC(C)CNCCOC(=O)C1=CC=C(C=C1)N
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Product OPENEYE NAME: 5-nitro-2-propoxy-aniline
CAS Name: 5-nitro-2-propoxyaniline
IUPAC NAME: 5-nitro-2-propoxyaniline
SYSTEMATIC NAME: 5-nitro-2-propoxy-aniline
MOLECULAR FORMULA: C9H12N2O3
MOLECULAR WEIGHT: 196.20318
SMILES: CCCOC1=C(C=C(C=C1)[N+](=O)[O-])N
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Product OPENEYE NAME: 2,4-dichloro-1-methoxy-benzene
CAS Name: 2,4-dichloro-1-methoxybenzene
IUPAC NAME: 2,4-dichloro-1-methoxybenzene
SYSTEMATIC NAME: 2,4-bis(chloranyl)-1-methoxy-benzene
MOLECULAR FORMULA: C7H6Cl2O
MOLECULAR WEIGHT: 177.02794
SMILES: COC1=C(C=C(C=C1)Cl)Cl
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Product OPENEYE NAME: dimethyl oxalate
CAS Name: oxalic acid dimethyl ester
IUPAC NAME: dimethyl oxalate
SYSTEMATIC NAME: dimethyl ethanedioate
MOLECULAR FORMULA: C4H6O4
MOLECULAR WEIGHT: 118.08804
SMILES: COC(=O)C(=O)OC
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Product OPENEYE NAME: 2-bromo-1,4-dimethyl-benzene
CAS Name: 2-bromo-1,4-dimethylbenzene
IUPAC NAME: 2-bromo-1,4-dimethylbenzene
SYSTEMATIC NAME: 2-bromanyl-1,4-dimethyl-benzene
MOLECULAR FORMULA: C8H9Br
MOLECULAR WEIGHT: 185.06106
SMILES: CC1=CC(=C(C=C1)C)Br
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Product OPENEYE NAME: 2-methyl-1,4-benzoquinone
CAS Name: 2-methylcyclohexa-2,5-diene-1,4-dione
IUPAC NAME: 2-methylcyclohexa-2,5-diene-1,4-dione
SYSTEMATIC NAME: 2-methylcyclohexa-2,5-diene-1,4-dione
MOLECULAR FORMULA: C7H6O2
MOLECULAR WEIGHT: 122.12134
SMILES: CC1=CC(=O)C=CC1=O
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Product OPENEYE NAME: 2,4-dichloroaniline
CAS Name: 2,4-dichloroaniline
IUPAC NAME: 2,4-dichloroaniline
SYSTEMATIC NAME: 2,4-bis(chloranyl)aniline
MOLECULAR FORMULA: C6H5Cl2N
MOLECULAR WEIGHT: 162.0166
SMILES: C1=CC(=C(C=C1Cl)Cl)N
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Product OPENEYE NAME: methyl propanoate
CAS Name: propanoic acid methyl ester
IUPAC NAME: methyl propanoate
SYSTEMATIC NAME: methyl propanoate
MOLECULAR FORMULA: C4H8O2
MOLECULAR WEIGHT: 88.10512
SMILES: CCC(=O)OC
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Product OPENEYE NAME: dilithium carbonate
CAS Name: dilithium carbonate
IUPAC NAME: dilithium carbonate
SYSTEMATIC NAME: dilithium carbonate
MOLECULAR FORMULA: CLi2O3
MOLECULAR WEIGHT: 73.8909
SMILES: [Li+].[Li+].C(=O)([O-])[O-]
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Product OPENEYE NAME: 2-methylthiophene
CAS Name: 2-methylthiophene
IUPAC NAME: 2-methylthiophene
SYSTEMATIC NAME: 2-methylthiophene
MOLECULAR FORMULA: C5H6S
MOLECULAR WEIGHT: 98.16614
SMILES: CC1=CC=CS1
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Product OPENEYE NAME: 2-(2,4,6-triiodophenoxy)butanoic acid
CAS Name: 2-(2,4,6-triiodophenoxy)butanoic acid
IUPAC NAME: 2-(2,4,6-triiodophenoxy)butanoic acid
SYSTEMATIC NAME: 2-[2,4,6-tris(iodanyl)phenoxy]butanoic acid
MOLECULAR FORMULA: C10H9I3O3
MOLECULAR WEIGHT: 557.89007
SMILES: CCC(C(=O)O)OC1=C(C=C(C=C1I)I)I
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Product OPENEYE NAME: 2-methyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-propanenitrile
CAS Name: 2-methyl-2-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]propanenitrile
IUPAC NAME: 2-methyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropanenitrile
SYSTEMATIC NAME: 2-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2-methyl-propanenitrile
MOLECULAR FORMULA: C10H17NO6
MOLECULAR WEIGHT: 247.24508
SMILES: CC(C)(C#N)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
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Product OPENEYE NAME: 7,7-dimethyl-3-methylene-norcarane
CAS Name: 7,7-dimethyl-4-methylenebicyclo[4.1.0]heptane
IUPAC NAME: 7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptane
SYSTEMATIC NAME: 7,7-dimethyl-4-methylidene-bicyclo[4.1.0]heptane
MOLECULAR FORMULA: C10H16
MOLECULAR WEIGHT: 136.23404
SMILES: CC1(C2C1CC(=C)CC2)C
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Product OPENEYE NAME: N,N-diethylethanamine hydrochloride
CAS Name: N,N-diethylethanamine hydrochloride
IUPAC NAME: N,N-diethylethanamine hydrochloride
SYSTEMATIC NAME: N,N-diethylethanamine hydrochloride
MOLECULAR FORMULA: C6H16ClN
MOLECULAR WEIGHT: 137.65094
SMILES: CCN(CC)CC.Cl
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Product OPENEYE NAME: 4-(4-anilinophenyl)azobenzenesulfonic acid
CAS Name: 4-(4-anilinophenyl)azobenzenesulfonic acid
IUPAC NAME: 4-[(4-anilinophenyl)diazenyl]benzenesulfonic acid
SYSTEMATIC NAME: 4-[(4-phenylazanylphenyl)diazenyl]benzenesulfonic acid
MOLECULAR FORMULA: C18H15N3O3S
MOLECULAR WEIGHT: 353.395
SMILES: C1=CC=C(C=C1)NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)S(=O)(=O)O
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Product OPENEYE NAME: (4-aminophenyl)stibonic acid
CAS Name: (4-aminophenyl)stibonic acid
IUPAC NAME: (4-aminophenyl)stibonic acid
SYSTEMATIC NAME: (4-aminophenyl)stibonic acid
MOLECULAR FORMULA: C6H8NO3Sb
MOLECULAR WEIGHT: 263.89262
SMILES: C1=CC(=CC=C1N)[Sb](=O)(O)O
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Product OPENEYE NAME: chloro-(4-sulfophenyl)mercury
CAS Name: chloro-(4-sulfophenyl)mercury
IUPAC NAME: chloro-(4-sulfophenyl)mercury
SYSTEMATIC NAME: chloranyl-(4-sulfophenyl)mercury
MOLECULAR FORMULA: C6H5ClHgO3S
MOLECULAR WEIGHT: 393.2101
SMILES: C1=CC(=CC=C1S(=O)(=O)O)[Hg]Cl
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Product OPENEYE NAME: 3-nitrophenol
CAS Name: 3-nitrophenol
IUPAC NAME: 3-nitrophenol
SYSTEMATIC NAME: 3-nitrophenol
MOLECULAR FORMULA: C6H5NO3
MOLECULAR WEIGHT: 139.1088
SMILES: C1=CC(=CC(=C1)O)[N+](=O)[O-]
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