Product OPENEYE NAME: (2-cyanophenyl) N-methylcarbamate
CAS Name: N-methylcarbamic acid (2-cyanophenyl) ester
IUPAC NAME: (2-cyanophenyl) N-methylcarbamate
SYSTEMATIC NAME: (2-cyanophenyl) N-methylcarbamate
MOLECULAR FORMULA: C9H8N2O2
MOLECULAR WEIGHT: 176.17202
SMILES: CNC(=O)OC1=CC=CC=C1C#N
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Product OPENEYE NAME: ethyl-[2-hydroxy-2-(3-hydroxyphenyl)ethyl]ammonium chloride
CAS Name: ethyl-[2-hydroxy-2-(3-hydroxyphenyl)ethyl]ammonium chloride
IUPAC NAME: ethyl-[2-hydroxy-2-(3-hydroxyphenyl)ethyl]azanium chloride
SYSTEMATIC NAME: ethyl-[2-(3-hydroxyphenyl)-2-oxidanyl-ethyl]azanium chloride
MOLECULAR FORMULA: C10H16ClNO2
MOLECULAR WEIGHT: 217.69254
SMILES: CC[NH2+]CC(C1=CC(=CC=C1)O)O.[Cl-]
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Product OPENEYE NAME: 1-(4-tert-butylphenyl)ethanone
CAS Name: 1-(4-tert-butylphenyl)ethanone
IUPAC NAME: 1-(4-tert-butylphenyl)ethanone
SYSTEMATIC NAME: 1-(4-tert-butylphenyl)ethanone
MOLECULAR FORMULA: C12H16O
MOLECULAR WEIGHT: 176.25484
SMILES: CC(=O)C1=CC=C(C=C1)C(C)(C)C
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H15NO2
MOLECULAR WEIGHT: 181.2316
SMILES: CCOC(=O)N1C2C1C3CCC2C3
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Product OPENEYE NAME: N-methyl-N-(4-nitrophenyl)nitrous amide
CAS Name: N-methyl-N-(4-nitrophenyl)nitrous amide
IUPAC NAME: N-methyl-N-(4-nitrophenyl)nitrous amide
SYSTEMATIC NAME: N-methyl-N-(4-nitrophenyl)nitrous amide
MOLECULAR FORMULA: C7H7N3O3
MOLECULAR WEIGHT: 181.14878
SMILES: CN(C1=CC=C(C=C1)[N+](=O)[O-])N=O
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Product OPENEYE NAME: 2-chloroethyl 2-phenylacetate
CAS Name: 2-phenylacetic acid 2-chloroethyl ester
IUPAC NAME: 2-chloroethyl 2-phenylacetate
SYSTEMATIC NAME: 2-chloroethyl 2-phenylethanoate
MOLECULAR FORMULA: C10H11ClO2
MOLECULAR WEIGHT: 198.64614
SMILES: C1=CC=C(C=C1)CC(=O)OCCCl
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Product OPENEYE NAME: 5-methyl-3-(piperidin-1-ium-1-ylmethyl)isoxazole chloride
CAS Name: 5-methyl-3-(1-piperidin-1-iumylmethyl)isoxazole chloride
IUPAC NAME: 5-methyl-3-(piperidin-1-ium-1-ylmethyl)-1,2-oxazole chloride
SYSTEMATIC NAME: 5-methyl-3-(piperidin-1-ium-1-ylmethyl)-1,2-oxazole chloride
MOLECULAR FORMULA: C10H17ClN2O
MOLECULAR WEIGHT: 216.70778
SMILES: CC1=CC(=NO1)C[NH+]2CCCCC2.[Cl-]
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Product OPENEYE NAME: 5-methyl-3-(1-piperidylmethyl)isoxazole
CAS Name: 5-methyl-3-(1-piperidinylmethyl)isoxazole
IUPAC NAME: 5-methyl-3-(piperidin-1-ylmethyl)-1,2-oxazole
SYSTEMATIC NAME: 5-methyl-3-(piperidin-1-ylmethyl)-1,2-oxazole
MOLECULAR FORMULA: C10H16N2O
MOLECULAR WEIGHT: 180.24684
SMILES: CC1=CC(=NO1)CN2CCCCC2
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Product OPENEYE NAME: [ethoxy(ethyl)phosphoryl]sulfanylbenzene
CAS Name: [[ethoxy(ethyl)phosphoryl]thio]benzene
IUPAC NAME: [ethoxy(ethyl)phosphoryl]sulfanylbenzene
SYSTEMATIC NAME: [ethoxy(ethyl)phosphoryl]sulfanylbenzene
MOLECULAR FORMULA: C10H15O2PS
MOLECULAR WEIGHT: 230.263661
SMILES: CCOP(=O)(CC)SC1=CC=CC=C1
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Product OPENEYE NAME: ethoxy-ethyl-phenylsulfanyl-thioxo-$l^{5}-phosphane
CAS Name: ethoxy-ethyl-(phenylthio)-sulfanylidenephosphorane
IUPAC NAME: ethoxy-ethyl-phenylsulfanyl-sulfanylidene-$l^{5}-phosphane
SYSTEMATIC NAME: ethoxy-ethyl-phenylsulfanyl-sulfanylidene-$l^{5}-phosphane
MOLECULAR FORMULA: C10H15OPS2
MOLECULAR WEIGHT: 246.329261
SMILES: CCOP(=S)(CC)SC1=CC=CC=C1
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Product OPENEYE NAME: 1,2,3,4-tetrachloro-5,6-dimethoxy-benzene
CAS Name: 1,2,3,4-tetrachloro-5,6-dimethoxybenzene
IUPAC NAME: 1,2,3,4-tetrachloro-5,6-dimethoxybenzene
SYSTEMATIC NAME: 1,2,3,4-tetrakis(chloranyl)-5,6-dimethoxy-benzene
MOLECULAR FORMULA: C8H6Cl4O2
MOLECULAR WEIGHT: 275.94404
SMILES: COC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)OC
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Product OPENEYE NAME: 1,2,4,5-tetrachloro-3,6-dimethoxy-benzene
CAS Name: 1,2,4,5-tetrachloro-3,6-dimethoxybenzene
IUPAC NAME: 1,2,4,5-tetrachloro-3,6-dimethoxybenzene
SYSTEMATIC NAME: 1,2,4,5-tetrakis(chloranyl)-3,6-dimethoxy-benzene
MOLECULAR FORMULA: C8H6Cl4O2
MOLECULAR WEIGHT: 275.94404
SMILES: COC1=C(C(=C(C(=C1Cl)Cl)OC)Cl)Cl
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Product OPENEYE NAME: benzenesulfinylbenzene
CAS Name: benzenesulfinylbenzene
IUPAC NAME: benzenesulfinylbenzene
SYSTEMATIC NAME: phenylsulfinylbenzene
MOLECULAR FORMULA: C12H10OS
MOLECULAR WEIGHT: 202.2722
SMILES: C1=CC=C(C=C1)S(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-chloro-4,6-dinitro-phenol
CAS Name: 2-chloro-4,6-dinitrophenol
IUPAC NAME: 2-chloro-4,6-dinitrophenol
SYSTEMATIC NAME: 2-chloranyl-4,6-dinitro-phenol
MOLECULAR FORMULA: C6H3ClN2O5
MOLECULAR WEIGHT: 218.55142
SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])O)Cl)[N+](=O)[O-]
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Product OPENEYE NAME: [2-(3,4-dihydroxyphenyl)-2-hydroxy-1-methyl-ethyl]-methyl-ammonium chloride
CAS Name: [1-(3,4-dihydroxyphenyl)-1-hydroxypropan-2-yl]-methylammonium chloride
IUPAC NAME: [1-(3,4-dihydroxyphenyl)-1-hydroxypropan-2-yl]-methylazanium chloride
SYSTEMATIC NAME: [1-[3,4-bis(oxidanyl)phenyl]-1-oxidanyl-propan-2-yl]-methyl-azanium chloride
MOLECULAR FORMULA: C10H16ClNO3
MOLECULAR WEIGHT: 233.69194
SMILES: CC(C(C1=CC(=C(C=C1)O)O)O)[NH2+]C.[Cl-]
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Product OPENEYE NAME: 4-[1-hydroxy-2-(methylamino)propyl]benzene-1,2-diol
CAS Name: 4-[1-hydroxy-2-(methylamino)propyl]benzene-1,2-diol
IUPAC NAME: 4-[1-hydroxy-2-(methylamino)propyl]benzene-1,2-diol
SYSTEMATIC NAME: 4-[2-(methylamino)-1-oxidanyl-propyl]benzene-1,2-diol
MOLECULAR FORMULA: C10H15NO3
MOLECULAR WEIGHT: 197.231
SMILES: CC(C(C1=CC(=C(C=C1)O)O)O)NC
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Product OPENEYE NAME: 2-[(5-nitro-2-furyl)methyleneamino]guanidine
CAS Name: 2-[(5-nitro-2-furanyl)methylideneamino]guanidine
IUPAC NAME: 2-[(5-nitrofuran-2-yl)methylideneamino]guanidine
SYSTEMATIC NAME: 2-[(5-nitrofuran-2-yl)methylideneamino]guanidine
MOLECULAR FORMULA: C6H7N5O3
MOLECULAR WEIGHT: 197.15148
SMILES: C1=C(OC(=C1)[N+](=O)[O-])C=NN=C(N)N
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Product OPENEYE NAME: 2-chloroethyl 2-phenoxyacetate
CAS Name: 2-phenoxyacetic acid 2-chloroethyl ester
IUPAC NAME: 2-chloroethyl 2-phenoxyacetate
SYSTEMATIC NAME: 2-chloroethyl 2-phenoxyethanoate
MOLECULAR FORMULA: C10H11ClO3
MOLECULAR WEIGHT: 214.64554
SMILES: C1=CC=C(C=C1)OCC(=O)OCCCl
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