Product OPENEYE NAME: 3,9-diethyltridecane-6-sulfonic acid
CAS Name: 3,9-diethyl-6-tridecanesulfonic acid
IUPAC NAME: 3,9-diethyltridecane-6-sulfonic acid
SYSTEMATIC NAME: 3,9-diethyltridecane-6-sulfonic acid
MOLECULAR FORMULA: C17H36O3S
MOLECULAR WEIGHT: 320.53094
SMILES: CCCCC(CC)CCC(CCC(CC)CC)S(=O)(=O)O
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Product OPENEYE NAME: 6-pentyl-1,3,5-triazine-2,4-diamine
CAS Name: 6-pentyl-1,3,5-triazine-2,4-diamine
IUPAC NAME: 6-pentyl-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: 6-pentyl-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C8H15N5
MOLECULAR WEIGHT: 181.2382
SMILES: CCCCCC1=NC(=NC(=N1)N)N
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Product OPENEYE NAME: 2-(azaniumylamino)ethyl-[(3-methoxyphenyl)methyl]-methyl-ammonium dichloride
CAS Name: 2-(ammonioamino)ethyl-[(3-methoxyphenyl)methyl]-methylammonium dichloride
IUPAC NAME: 2-(azaniumylamino)ethyl-[(3-methoxyphenyl)methyl]-methylazanium dichloride
SYSTEMATIC NAME: 2-(azaniumylamino)ethyl-[(3-methoxyphenyl)methyl]-methyl-azanium dichloride
MOLECULAR FORMULA: C11H21Cl2N3O
MOLECULAR WEIGHT: 282.20994
SMILES: C[NH+](CCN[NH3+])CC1=CC(=CC=C1)OC.[Cl-].[Cl-]
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Product OPENEYE NAME: 2-hydrazino-N-[(3-methoxyphenyl)methyl]-N-methyl-ethanamine
CAS Name: 2-hydrazinyl-N-[(3-methoxyphenyl)methyl]-N-methylethanamine
IUPAC NAME: 2-hydrazinyl-N-[(3-methoxyphenyl)methyl]-N-methylethanamine
SYSTEMATIC NAME: 2-diazanyl-N-[(3-methoxyphenyl)methyl]-N-methyl-ethanamine
MOLECULAR FORMULA: C11H19N3O
MOLECULAR WEIGHT: 209.28806
SMILES: CN(CCNN)CC1=CC(=CC=C1)OC
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Product OPENEYE NAME: (5-acetyl-2-ethoxycarbonyl-1H-indol-3-yl)methyl-dimethyl-ammonium chloride
CAS Name: (5-acetyl-2-ethoxycarbonyl-1H-indol-3-yl)methyl-dimethylammonium chloride
IUPAC NAME: (5-acetyl-2-ethoxycarbonyl-1H-indol-3-yl)methyl-dimethylazanium chloride
SYSTEMATIC NAME: (5-ethanoyl-2-ethoxycarbonyl-1H-indol-3-yl)methyl-dimethyl-azanium chloride
MOLECULAR FORMULA: C16H21ClN2O3
MOLECULAR WEIGHT: 324.80254
SMILES: CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)C(=O)C)C[NH+](C)C.[Cl-]
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Product OPENEYE NAME: ethyl 5-acetyl-3-[(dimethylamino)methyl]-1H-indole-2-carboxylate
CAS Name: 5-acetyl-3-[(dimethylamino)methyl]-1H-indole-2-carboxylic acid ethyl ester
IUPAC NAME: ethyl 5-acetyl-3-[(dimethylamino)methyl]-1H-indole-2-carboxylate
SYSTEMATIC NAME: ethyl 3-[(dimethylamino)methyl]-5-ethanoyl-1H-indole-2-carboxylate
MOLECULAR FORMULA: C16H20N2O3
MOLECULAR WEIGHT: 288.3416
SMILES: CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)C(=O)C)CN(C)C
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Product OPENEYE NAME: 2-benzyl-4,6-ditert-butyl-phenol
CAS Name: 2,4-ditert-butyl-6-(phenylmethyl)phenol
IUPAC NAME: 2-benzyl-4,6-ditert-butylphenol
SYSTEMATIC NAME: 2,4-ditert-butyl-6-(phenylmethyl)phenol
MOLECULAR FORMULA: C21H28O
MOLECULAR WEIGHT: 296.44642
SMILES: CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)O)CC2=CC=CC=C2
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Product OPENEYE NAME: dihexoxy-sulfanyl-thioxo-$l^{5}-phosphane
CAS Name: dihexoxy-mercapto-sulfanylidenephosphorane
IUPAC NAME: dihexoxy-sulfanyl-sulfanylidene-$l^{5}-phosphane
SYSTEMATIC NAME: dihexoxy-sulfanyl-sulfanylidene-$l^{5}-phosphane
MOLECULAR FORMULA: C12H27O2PS2
MOLECULAR WEIGHT: 298.445341
SMILES: CCCCCCOP(=S)(OCCCCCC)S
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Product OPENEYE NAME: benzylammonium chloride
CAS Name: (phenylmethyl)ammonium chloride
IUPAC NAME: benzylazanium chloride
SYSTEMATIC NAME: (phenylmethyl)azanium chloride
MOLECULAR FORMULA: C7H10ClN
MOLECULAR WEIGHT: 143.614
SMILES: C1=CC=C(C=C1)C[NH3+].[Cl-]
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Product OPENEYE NAME: diethoxy-methylsulfanyl-thioxo-$l^{5}-phosphane
CAS Name: diethoxy-(methylthio)-sulfanylidenephosphorane
IUPAC NAME: diethoxy-methylsulfanyl-sulfanylidene-$l^{5}-phosphane
SYSTEMATIC NAME: diethoxy-methylsulfanyl-sulfanylidene-$l^{5}-phosphane
MOLECULAR FORMULA: C5H13O2PS2
MOLECULAR WEIGHT: 200.259281
SMILES: CCOP(=S)(OCC)SC
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Product OPENEYE NAME: amino(trimethyl)ammonium iodide
CAS Name: amino(trimethyl)ammonium iodide
IUPAC NAME: amino(trimethyl)azanium iodide
SYSTEMATIC NAME: azanyl(trimethyl)azanium iodide
MOLECULAR FORMULA: C3H11IN2
MOLECULAR WEIGHT: 202.03731
SMILES: C[N+](C)(C)N.[I-]
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Product OPENEYE NAME: amino(trimethyl)ammonium
CAS Name: amino(trimethyl)ammonium
IUPAC NAME: amino(trimethyl)azanium
SYSTEMATIC NAME: azanyl(trimethyl)azanium
MOLECULAR FORMULA: C3H11N2+
MOLECULAR WEIGHT: 75.13284
SMILES: C[N+](C)(C)N
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Product OPENEYE NAME: 2-(4-tert-butylphenyl)ethanehydroxamic acid
CAS Name: 2-(4-tert-butylphenyl)-N-hydroxyacetamide
IUPAC NAME: 2-(4-tert-butylphenyl)-N-hydroxyacetamide
SYSTEMATIC NAME: 2-(4-tert-butylphenyl)-N-oxidanyl-ethanamide
MOLECULAR FORMULA: C12H17NO2
MOLECULAR WEIGHT: 207.26888
SMILES: CC(C)(C)C1=CC=C(C=C1)CC(=O)NO
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Product OPENEYE NAME: ethyl cyclohexanecarboxylate
CAS Name: cyclohexanecarboxylic acid ethyl ester
IUPAC NAME: ethyl cyclohexanecarboxylate
SYSTEMATIC NAME: ethyl cyclohexanecarboxylate
MOLECULAR FORMULA: C9H16O2
MOLECULAR WEIGHT: 156.22214
SMILES: CCOC(=O)C1CCCCC1
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Product OPENEYE NAME: 2-methylallylbenzene
CAS Name: 2-methylprop-2-enylbenzene
IUPAC NAME: 2-methylprop-2-enylbenzene
SYSTEMATIC NAME: 2-methylprop-2-enylbenzene
MOLECULAR FORMULA: C10H12
MOLECULAR WEIGHT: 132.20228
SMILES: CC(=C)CC1=CC=CC=C1
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Product OPENEYE NAME: 2,4,4,4-tetrachlorobutan-1-ol
CAS Name: 2,4,4,4-tetrachloro-1-butanol
IUPAC NAME: 2,4,4,4-tetrachlorobutan-1-ol
SYSTEMATIC NAME: 2,4,4,4-tetrakis(chloranyl)butan-1-ol
MOLECULAR FORMULA: C4H6Cl4O
MOLECULAR WEIGHT: 211.90184
SMILES: C(C(CO)Cl)C(Cl)(Cl)Cl
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Product OPENEYE NAME: 2,2-bis(2-methylprop-2-enoyloxymethyl)butyl 2-methylprop-2-enoate
CAS Name: 2-methyl-2-propenoic acid 2,2-bis[(2-methyl-1-oxoprop-2-enoxy)methyl]butyl ester
IUPAC NAME: 2,2-bis(2-methylprop-2-enoyloxymethyl)butyl 2-methylprop-2-enoate
SYSTEMATIC NAME: 2,2-bis(2-methylprop-2-enoyloxymethyl)butyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C18H26O6
MOLECULAR WEIGHT: 338.39544
SMILES: CCC(COC(=O)C(=C)C)(COC(=O)C(=C)C)COC(=O)C(=C)C
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Product OPENEYE NAME: 2-methoxyacridine
CAS Name: 2-methoxyacridine
IUPAC NAME: 2-methoxyacridine
SYSTEMATIC NAME: 2-methoxyacridine
MOLECULAR FORMULA: C14H11NO
MOLECULAR WEIGHT: 209.24324
SMILES: COC1=CC2=CC3=CC=CC=C3N=C2C=C1
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