Product OPENEYE NAME: 5-methoxypentan-1-ol
CAS Name: 5-methoxy-1-pentanol
IUPAC NAME: 5-methoxypentan-1-ol
SYSTEMATIC NAME: 5-methoxypentan-1-ol
MOLECULAR FORMULA: C6H14O2
MOLECULAR WEIGHT: 118.17416
SMILES: COCCCCCO
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Product OPENEYE NAME: 2-(1-phenylethoxy)ethanol
CAS Name: 2-(1-phenylethoxy)ethanol
IUPAC NAME: 2-(1-phenylethoxy)ethanol
SYSTEMATIC NAME: 2-(1-phenylethoxy)ethanol
MOLECULAR FORMULA: C10H14O2
MOLECULAR WEIGHT: 166.21696
SMILES: CC(C1=CC=CC=C1)OCCO
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Product OPENEYE NAME: disodium (2S,5R,6R)-6-[(2-carboxylato-2-phenyl-acetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
CAS Name: disodium (2S,5R,6R)-6-[(2-carboxylato-1-oxo-2-phenylethyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
IUPAC NAME: disodium (2S,5R,6R)-6-[(2-carboxylato-2-phenylacetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
SYSTEMATIC NAME: disodium (2S,5R,6R)-3,3-dimethyl-6-[(3-oxidanidyl-3-oxidanylidene-2-phenyl-propanoyl)amino]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
MOLECULAR FORMULA: C17H16N2Na2O6S
MOLECULAR WEIGHT: 422.36328
SMILES: CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(C3=CC=CC=C3)C(=O)[O-])C(=O)[O-])C.[Na+].[Na+]
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Product OPENEYE NAME: (2-acetamidophenyl)ammonium chloride
CAS Name: (2-acetamidophenyl)ammonium chloride
IUPAC NAME: (2-acetamidophenyl)azanium chloride
SYSTEMATIC NAME: (2-acetamidophenyl)azanium chloride
MOLECULAR FORMULA: C8H11ClN2O
MOLECULAR WEIGHT: 186.63874
SMILES: CC(=O)NC1=CC=CC=C1[NH3+].[Cl-]
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Product OPENEYE NAME: 1-hydroxypiperidine
CAS Name: 1-hydroxypiperidine
IUPAC NAME: 1-hydroxypiperidine
SYSTEMATIC NAME: 1-oxidanylpiperidine
MOLECULAR FORMULA: C5H11NO
MOLECULAR WEIGHT: 101.14694
SMILES: C1CCN(CC1)O
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Product OPENEYE NAME: 2-methyl-5-(1-methyl-2-sulfanyl-ethyl)cyclohexanethiol
CAS Name: 5-(1-mercaptopropan-2-yl)-2-methyl-1-cyclohexanethiol
IUPAC NAME: 2-methyl-5-(1-sulfanylpropan-2-yl)cyclohexane-1-thiol
SYSTEMATIC NAME: 2-methyl-5-(1-sulfanylpropan-2-yl)cyclohexane-1-thiol
MOLECULAR FORMULA: C10H20S2
MOLECULAR WEIGHT: 204.3958
SMILES: CC1CCC(CC1S)C(C)CS
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Product OPENEYE NAME: diethyl-[2-[3-(1-methylpyrrolidin-1-ium-2-yl)indol-1-yl]ethyl]ammonium dichloride
CAS Name: diethyl-[2-[3-(1-methyl-2-pyrrolidin-1-iumyl)-1-indolyl]ethyl]ammonium dichloride
IUPAC NAME: diethyl-[2-[3-(1-methylpyrrolidin-1-ium-2-yl)indol-1-yl]ethyl]azanium dichloride
SYSTEMATIC NAME: diethyl-[2-[3-(1-methylpyrrolidin-1-ium-2-yl)indol-1-yl]ethyl]azanium dichloride
MOLECULAR FORMULA: C19H31Cl2N3
MOLECULAR WEIGHT: 372.37554
SMILES: CC[NH+](CC)CCN1C=C(C2=CC=CC=C21)C3CCC[NH+]3C.[Cl-].[Cl-]
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Product OPENEYE NAME: N,N-diethyl-2-[3-(1-methylpyrrolidin-2-yl)indol-1-yl]ethanamine
CAS Name: N,N-diethyl-2-[3-(1-methyl-2-pyrrolidinyl)-1-indolyl]ethanamine
IUPAC NAME: N,N-diethyl-2-[3-(1-methylpyrrolidin-2-yl)indol-1-yl]ethanamine
SYSTEMATIC NAME: N,N-diethyl-2-[3-(1-methylpyrrolidin-2-yl)indol-1-yl]ethanamine
MOLECULAR FORMULA: C19H29N3
MOLECULAR WEIGHT: 299.45366
SMILES: CCN(CC)CCN1C=C(C2=CC=CC=C21)C3CCCN3C
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Product OPENEYE NAME: 2,4-dichloro-6-(diazomethyl)-1,3,5-triazine
CAS Name: 2,4-dichloro-6-(diazomethyl)-1,3,5-triazine
IUPAC NAME: 2,4-dichloro-6-(diazomethyl)-1,3,5-triazine
SYSTEMATIC NAME: 2,4-bis(chloranyl)-6-(diazomethyl)-1,3,5-triazine
MOLECULAR FORMULA: C4HCl2N5
MOLECULAR WEIGHT: 189.99024
SMILES: C(=[N+]=[N-])C1=NC(=NC(=N1)Cl)Cl
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Product OPENEYE NAME: 2-(diazomethyl)-4,6-dimethoxy-1,3,5-triazine
CAS Name: 2-(diazomethyl)-4,6-dimethoxy-1,3,5-triazine
IUPAC NAME: 2-(diazomethyl)-4,6-dimethoxy-1,3,5-triazine
SYSTEMATIC NAME: 2-(diazomethyl)-4,6-dimethoxy-1,3,5-triazine
MOLECULAR FORMULA: C6H7N5O2
MOLECULAR WEIGHT: 181.15208
SMILES: COC1=NC(=NC(=N1)C=[N+]=[N-])OC
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Product OPENEYE NAME: 2,4,6-tributyl-1,3,5-triazine
CAS Name: 2,4,6-tributyl-1,3,5-triazine
IUPAC NAME: 2,4,6-tributyl-1,3,5-triazine
SYSTEMATIC NAME: 2,4,6-tributyl-1,3,5-triazine
MOLECULAR FORMULA: C15H27N3
MOLECULAR WEIGHT: 249.39498
SMILES: CCCCC1=NC(=NC(=N1)CCCC)CCCC
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Product OPENEYE NAME: 3-(4,6-dihydroxy-3-methyl-11-oxo-5,6,6a,7-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl)prop-2-enamide
CAS Name: 3-(4,6-dihydroxy-3-methyl-11-oxo-5,6,6a,7-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl)-2-propenamide
IUPAC NAME: 3-(4,6-dihydroxy-3-methyl-11-oxo-5,6,6a,7-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl)prop-2-enamide
SYSTEMATIC NAME: 3-[3-methyl-4,6-bis(oxidanyl)-11-oxidanylidene-5,6,6a,7-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl]prop-2-enamide
MOLECULAR FORMULA: C16H17N3O4
MOLECULAR WEIGHT: 315.32388
SMILES: CC1=C(C2=C(C=C1)C(=O)N3C=C(CC3C(N2)O)C=CC(=O)N)O
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Product OPENEYE NAME: 3,3-dimethyl-7-oxo-6-[(2-phenylsulfanylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
CAS Name: 3,3-dimethyl-7-oxo-6-[[1-oxo-2-(phenylthio)ethyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
IUPAC NAME: 3,3-dimethyl-7-oxo-6-[(2-phenylsulfanylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
SYSTEMATIC NAME: 3,3-dimethyl-7-oxidanylidene-6-(2-phenylsulfanylethanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
MOLECULAR FORMULA: C16H18N2O4S2
MOLECULAR WEIGHT: 366.45512
SMILES: CC1(C(N2C(S1)C(C2=O)NC(=O)CSC3=CC=CC=C3)C(=O)O)C
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Product OPENEYE NAME: 2,6-dimethyl-4-nitro-1-oxido-pyridin-1-ium
CAS Name: 2,6-dimethyl-4-nitro-1-oxidopyridin-1-ium
IUPAC NAME: 2,6-dimethyl-4-nitro-1-oxidopyridin-1-ium
SYSTEMATIC NAME: 2,6-dimethyl-4-nitro-1-oxidanidyl-pyridin-1-ium
MOLECULAR FORMULA: C7H8N2O3
MOLECULAR WEIGHT: 168.15002
SMILES: CC1=CC(=CC(=[N+]1[O-])C)[N+](=O)[O-]
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Product OPENEYE NAME: 3-methylhept-1-ene
CAS Name: 3-methyl-1-heptene
IUPAC NAME: 3-methylhept-1-ene
SYSTEMATIC NAME: 3-methylhept-1-ene
MOLECULAR FORMULA: C8H16
MOLECULAR WEIGHT: 112.21264
SMILES: CCCCC(C)C=C
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Product OPENEYE NAME: 3-(6,11-dihydrobenzo[b][1,4]benzodiazepin-5-yl)propyl-dimethyl-ammonium chloride
CAS Name: 3-(6,11-dihydrobenzo[b][1,4]benzodiazepin-5-yl)propyl-dimethylammonium chloride
IUPAC NAME: 3-(6,11-dihydrobenzo[b][1,4]benzodiazepin-5-yl)propyl-dimethylazanium chloride
SYSTEMATIC NAME: 3-(6,11-dihydrobenzo[b][1,4]benzodiazepin-5-yl)propyl-dimethyl-azanium chloride
MOLECULAR FORMULA: C18H24ClN3
MOLECULAR WEIGHT: 317.85626
SMILES: C[NH+](C)CCCN1CC2=CC=CC=C2NC3=CC=CC=C31.[Cl-]
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Product OPENEYE NAME: 3-(6,11-dihydrobenzo[b][1,4]benzodiazepin-5-yl)-N,N-dimethyl-propan-1-amine
CAS Name: 3-(6,11-dihydrobenzo[b][1,4]benzodiazepin-5-yl)-N,N-dimethyl-1-propanamine
IUPAC NAME: 3-(6,11-dihydrobenzo[b][1,4]benzodiazepin-5-yl)-N,N-dimethylpropan-1-amine
SYSTEMATIC NAME: 3-(6,11-dihydrobenzo[b][1,4]benzodiazepin-5-yl)-N,N-dimethyl-propan-1-amine
MOLECULAR FORMULA: C18H23N3
MOLECULAR WEIGHT: 281.39532
SMILES: CN(C)CCCN1CC2=CC=CC=C2NC3=CC=CC=C31
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Product OPENEYE NAME: 2-isopropoxyphenol
CAS Name: 2-propan-2-yloxyphenol
IUPAC NAME: 2-propan-2-yloxyphenol
SYSTEMATIC NAME: 2-propan-2-yloxyphenol
MOLECULAR FORMULA: C9H12O2
MOLECULAR WEIGHT: 152.19038
SMILES: CC(C)OC1=CC=CC=C1O
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Product OPENEYE NAME: 3-nitrohex-3-ene
CAS Name: 3-nitro-3-hexene
IUPAC NAME: 3-nitrohex-3-ene
SYSTEMATIC NAME: 3-nitrohex-3-ene
MOLECULAR FORMULA: C6H11NO2
MOLECULAR WEIGHT: 129.15704
SMILES: CCC=C(CC)[N+](=O)[O-]
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Product OPENEYE NAME: 2-nitrobut-2-ene
CAS Name: 2-nitro-2-butene
IUPAC NAME: 2-nitrobut-2-ene
SYSTEMATIC NAME: 2-nitrobut-2-ene
MOLECULAR FORMULA: C4H7NO2
MOLECULAR WEIGHT: 101.10388
SMILES: CC=C(C)[N+](=O)[O-]
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Product OPENEYE NAME: 3,6-dimethyloctanoic acid
CAS Name: 3,6-dimethyloctanoic acid
IUPAC NAME: 3,6-dimethyloctanoic acid
SYSTEMATIC NAME: 3,6-dimethyloctanoic acid
MOLECULAR FORMULA: C10H20O2
MOLECULAR WEIGHT: 172.2646
SMILES: CCC(C)CCC(C)CC(=O)O
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Product OPENEYE NAME: N-(cinnamylideneamino)pyridine-4-carboxamide
CAS Name: N-(cinnamylideneamino)-4-pyridinecarboxamide
IUPAC NAME: N-(cinnamylideneamino)pyridine-4-carboxamide
SYSTEMATIC NAME: N-(cinnamylideneamino)pyridine-4-carboxamide
MOLECULAR FORMULA: C15H13N3O
MOLECULAR WEIGHT: 251.28322
SMILES: C1=CC=C(C=C1)C=CC=NNC(=O)C2=CC=NC=C2
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Product OPENEYE NAME: N-(benzhydrylideneamino)pyridine-4-carboxamide
CAS Name: N-[(diphenylmethylene)amino]-4-pyridinecarboxamide
IUPAC NAME: N-(benzhydrylideneamino)pyridine-4-carboxamide
SYSTEMATIC NAME: N-[(diphenylmethylidene)amino]pyridine-4-carboxamide
MOLECULAR FORMULA: C19H15N3O
MOLECULAR WEIGHT: 301.3419
SMILES: C1=CC=C(C=C1)C(=NNC(=O)C2=CC=NC=C2)C3=CC=CC=C3
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