Product OPENEYE NAME: 2-[(4,5-difluoro-3-hydroxy-2-thienyl)methyl]butanoic acid
CAS Name: 2-[(4,5-difluoro-3-hydroxy-2-thiophenyl)methyl]butanoic acid
IUPAC NAME: 2-[(4,5-difluoro-3-hydroxythiophen-2-yl)methyl]butanoic acid
SYSTEMATIC NAME: 2-[[4,5-bis(fluoranyl)-3-oxidanyl-thiophen-2-yl]methyl]butanoic acid
MOLECULAR FORMULA: C9H10F2O3S
MOLECULAR WEIGHT: 236.235706
SMILES: CCC(CC1=C(C(=C(S1)F)F)O)C(=O)O
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Product OPENEYE NAME: 3-(3,4-difluoro-2-pyridyl)propanoic acid
CAS Name: 3-(3,4-difluoro-2-pyridinyl)propanoic acid
IUPAC NAME: 3-(3,4-difluoropyridin-2-yl)propanoic acid
SYSTEMATIC NAME: 3-[3,4-bis(fluoranyl)pyridin-2-yl]propanoic acid
MOLECULAR FORMULA: C8H7F2NO2
MOLECULAR WEIGHT: 187.143486
SMILES: C1=CN=C(C(=C1F)F)CCC(=O)O
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Product OPENEYE NAME: 2,3-difluoro-2-hydroxy-3-(4-pyridyl)pentanoate
CAS Name: 2,3-difluoro-2-hydroxy-3-pyridin-4-ylpentanoate
IUPAC NAME: 2,3-difluoro-2-hydroxy-3-pyridin-4-ylpentanoate
SYSTEMATIC NAME: 2,3-bis(fluoranyl)-2-oxidanyl-3-pyridin-4-yl-pentanoate
MOLECULAR FORMULA: C10H10F2NO3-
MOLECULAR WEIGHT: 230.188106
SMILES: CCC(C1=CC=NC=C1)(C(C(=O)[O-])(O)F)F
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Product OPENEYE NAME: 2,3-difluoro-2-hydroxy-3-(4-pyridyl)pentanoic acid
CAS Name: 2,3-difluoro-2-hydroxy-3-pyridin-4-ylpentanoic acid
IUPAC NAME: 2,3-difluoro-2-hydroxy-3-pyridin-4-ylpentanoic acid
SYSTEMATIC NAME: 2,3-bis(fluoranyl)-2-oxidanyl-3-pyridin-4-yl-pentanoic acid
MOLECULAR FORMULA: C10H11F2NO3
MOLECULAR WEIGHT: 231.196046
SMILES: CCC(C1=CC=NC=C1)(C(C(=O)O)(O)F)F
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Product OPENEYE NAME: 2-ethylhexyl 3,5-dinitrobenzoate
CAS Name: 3,5-dinitrobenzoic acid 2-ethylhexyl ester
IUPAC NAME: 2-ethylhexyl 3,5-dinitrobenzoate
SYSTEMATIC NAME: 2-ethylhexyl 3,5-dinitrobenzoate
MOLECULAR FORMULA: C15H20N2O6
MOLECULAR WEIGHT: 324.3291
SMILES: CCCCC(CC)COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: N,N-bis(2-ethylhexyl)-3,5-dinitro-benzamide
CAS Name: N,N-bis(2-ethylhexyl)-3,5-dinitrobenzamide
IUPAC NAME: N,N-bis(2-ethylhexyl)-3,5-dinitrobenzamide
SYSTEMATIC NAME: N,N-bis(2-ethylhexyl)-3,5-dinitro-benzamide
MOLECULAR FORMULA: C23H37N3O5
MOLECULAR WEIGHT: 435.55698
SMILES: CCCCC(CC)CN(CC(CC)CCCC)C(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 1-butyl-6-methyl-3,5-dinitro-cyclohexa-2,4-diene-1-carboxylate
CAS Name: 1-butyl-6-methyl-3,5-dinitro-1-cyclohexa-2,4-dienecarboxylate
IUPAC NAME: 1-butyl-6-methyl-3,5-dinitrocyclohexa-2,4-diene-1-carboxylate
SYSTEMATIC NAME: 1-butyl-6-methyl-3,5-dinitro-cyclohexa-2,4-diene-1-carboxylate
MOLECULAR FORMULA: C12H15N2O6-
MOLECULAR WEIGHT: 283.2573
SMILES: CCCCC1(C=C(C=C(C1C)[N+](=O)[O-])[N+](=O)[O-])C(=O)[O-]
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Product OPENEYE NAME: 1-butyl-6-methyl-3,5-dinitro-cyclohexa-2,4-diene-1-carboxylic acid
CAS Name: 1-butyl-6-methyl-3,5-dinitro-1-cyclohexa-2,4-dienecarboxylic acid
IUPAC NAME: 1-butyl-6-methyl-3,5-dinitrocyclohexa-2,4-diene-1-carboxylic acid
SYSTEMATIC NAME: 1-butyl-6-methyl-3,5-dinitro-cyclohexa-2,4-diene-1-carboxylic acid
MOLECULAR FORMULA: C12H16N2O6
MOLECULAR WEIGHT: 284.26524
SMILES: CCCCC1(C=C(C=C(C1C)[N+](=O)[O-])[N+](=O)[O-])C(=O)O
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Product OPENEYE NAME: 3,5-dinitro-2-octyl-benzoate
CAS Name: 3,5-dinitro-2-octylbenzoate
IUPAC NAME: 3,5-dinitro-2-octylbenzoate
SYSTEMATIC NAME: 3,5-dinitro-2-octyl-benzoate
MOLECULAR FORMULA: C15H19N2O6-
MOLECULAR WEIGHT: 323.32116
SMILES: CCCCCCCCC1=C(C=C(C=C1C(=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 3,5-dinitro-2-octyl-benzoic acid
CAS Name: 3,5-dinitro-2-octylbenzoic acid
IUPAC NAME: 3,5-dinitro-2-octylbenzoic acid
SYSTEMATIC NAME: 3,5-dinitro-2-octyl-benzoic acid
MOLECULAR FORMULA: C15H20N2O6
MOLECULAR WEIGHT: 324.3291
SMILES: CCCCCCCCC1=C(C=C(C=C1C(=O)O)[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 4-methyl-3,5-dinitro-2-pentyl-benzoate
CAS Name: 4-methyl-3,5-dinitro-2-pentylbenzoate
IUPAC NAME: 4-methyl-3,5-dinitro-2-pentylbenzoate
SYSTEMATIC NAME: 4-methyl-3,5-dinitro-2-pentyl-benzoate
MOLECULAR FORMULA: C13H15N2O6-
MOLECULAR WEIGHT: 295.268
SMILES: CCCCCC1=C(C(=C(C=C1C(=O)[O-])[N+](=O)[O-])C)[N+](=O)[O-]
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Product OPENEYE NAME: 4-methyl-3,5-dinitro-2-pentyl-benzoic acid
CAS Name: 4-methyl-3,5-dinitro-2-pentylbenzoic acid
IUPAC NAME: 4-methyl-3,5-dinitro-2-pentylbenzoic acid
SYSTEMATIC NAME: 4-methyl-3,5-dinitro-2-pentyl-benzoic acid
MOLECULAR FORMULA: C13H16N2O6
MOLECULAR WEIGHT: 296.27594
SMILES: CCCCCC1=C(C(=C(C=C1C(=O)O)[N+](=O)[O-])C)[N+](=O)[O-]
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Product OPENEYE NAME: 1-butyl-6-ethyl-3,5-dinitro-cyclohexa-2,4-diene-1-carboxylate
CAS Name: 1-butyl-6-ethyl-3,5-dinitro-1-cyclohexa-2,4-dienecarboxylate
IUPAC NAME: 1-butyl-6-ethyl-3,5-dinitrocyclohexa-2,4-diene-1-carboxylate
SYSTEMATIC NAME: 1-butyl-6-ethyl-3,5-dinitro-cyclohexa-2,4-diene-1-carboxylate
MOLECULAR FORMULA: C13H17N2O6-
MOLECULAR WEIGHT: 297.28388
SMILES: CCCCC1(C=C(C=C(C1CC)[N+](=O)[O-])[N+](=O)[O-])C(=O)[O-]
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Product OPENEYE NAME: 1-butyl-6-ethyl-3,5-dinitro-cyclohexa-2,4-diene-1-carboxylic acid
CAS Name: 1-butyl-6-ethyl-3,5-dinitro-1-cyclohexa-2,4-dienecarboxylic acid
IUPAC NAME: 1-butyl-6-ethyl-3,5-dinitrocyclohexa-2,4-diene-1-carboxylic acid
SYSTEMATIC NAME: 1-butyl-6-ethyl-3,5-dinitro-cyclohexa-2,4-diene-1-carboxylic acid
MOLECULAR FORMULA: C13H18N2O6
MOLECULAR WEIGHT: 298.29182
SMILES: CCCCC1(C=C(C=C(C1CC)[N+](=O)[O-])[N+](=O)[O-])C(=O)O
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Product OPENEYE NAME: 6-methyl-3,5-dinitro-1-pentyl-cyclohexa-2,4-diene-1-carboxylate
CAS Name: 6-methyl-3,5-dinitro-1-pentyl-1-cyclohexa-2,4-dienecarboxylate
IUPAC NAME: 6-methyl-3,5-dinitro-1-pentylcyclohexa-2,4-diene-1-carboxylate
SYSTEMATIC NAME: 6-methyl-3,5-dinitro-1-pentyl-cyclohexa-2,4-diene-1-carboxylate
MOLECULAR FORMULA: C13H17N2O6-
MOLECULAR WEIGHT: 297.28388
SMILES: CCCCCC1(C=C(C=C(C1C)[N+](=O)[O-])[N+](=O)[O-])C(=O)[O-]
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Product OPENEYE NAME: 6-methyl-3,5-dinitro-1-pentyl-cyclohexa-2,4-diene-1-carboxylic acid
CAS Name: 6-methyl-3,5-dinitro-1-pentyl-1-cyclohexa-2,4-dienecarboxylic acid
IUPAC NAME: 6-methyl-3,5-dinitro-1-pentylcyclohexa-2,4-diene-1-carboxylic acid
SYSTEMATIC NAME: 6-methyl-3,5-dinitro-1-pentyl-cyclohexa-2,4-diene-1-carboxylic acid
MOLECULAR FORMULA: C13H18N2O6
MOLECULAR WEIGHT: 298.29182
SMILES: CCCCCC1(C=C(C=C(C1C)[N+](=O)[O-])[N+](=O)[O-])C(=O)O
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Product OPENEYE NAME: 2-hexoxyethyl 3,5-dinitrobenzoate
CAS Name: 3,5-dinitrobenzoic acid 2-hexoxyethyl ester
IUPAC NAME: 2-hexoxyethyl 3,5-dinitrobenzoate
SYSTEMATIC NAME: 2-hexoxyethyl 3,5-dinitrobenzoate
MOLECULAR FORMULA: C15H20N2O7
MOLECULAR WEIGHT: 340.3285
SMILES: CCCCCCOCCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 2-(2-propoxyethoxy)ethyl 3,5-dinitrobenzoate
CAS Name: 3,5-dinitrobenzoic acid 2-(2-propoxyethoxy)ethyl ester
IUPAC NAME: 2-(2-propoxyethoxy)ethyl 3,5-dinitrobenzoate
SYSTEMATIC NAME: 2-(2-propoxyethoxy)ethyl 3,5-dinitrobenzoate
MOLECULAR FORMULA: C14H18N2O8
MOLECULAR WEIGHT: 342.30132
SMILES: CCCOCCOCCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]
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