Product OPENEYE NAME: 6-bromo-3-(2-pyridyl)chromen-2-one
CAS Name: 6-bromo-3-(2-pyridinyl)-1-benzopyran-2-one
IUPAC NAME: 6-bromo-3-pyridin-2-ylchromen-2-one
SYSTEMATIC NAME: 6-bromanyl-3-pyridin-2-yl-chromen-2-one
MOLECULAR FORMULA: C14H8BrNO2
MOLECULAR WEIGHT: 302.12282
SMILES: C1=CC=NC(=C1)C2=CC3=C(C=CC(=C3)Br)OC2=O
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Product OPENEYE NAME: N-(1-methylpropylideneamino)-2,4-dinitro-aniline
CAS Name: N-(butan-2-ylideneamino)-2,4-dinitroaniline
IUPAC NAME: N-(butan-2-ylideneamino)-2,4-dinitroaniline
SYSTEMATIC NAME: N-(butan-2-ylideneamino)-2,4-dinitro-aniline
MOLECULAR FORMULA: C10H12N4O4
MOLECULAR WEIGHT: 252.22668
SMILES: CCC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C
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Product OPENEYE NAME: dimethyl-[2-[2-pyridyl(3-thienylmethyl)amino]ethyl]ammonium chloride
CAS Name: dimethyl-[2-[2-pyridinyl(3-thiophenylmethyl)amino]ethyl]ammonium chloride
IUPAC NAME: dimethyl-[2-[pyridin-2-yl(thiophen-3-ylmethyl)amino]ethyl]azanium chloride
SYSTEMATIC NAME: dimethyl-[2-[pyridin-2-yl(thiophen-3-ylmethyl)amino]ethyl]azanium chloride
MOLECULAR FORMULA: C14H20ClN3S
MOLECULAR WEIGHT: 297.8467
SMILES: C[NH+](C)CCN(CC1=CSC=C1)C2=CC=CC=N2.[Cl-]
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Product OPENEYE NAME: (7-aminophenothiazin-3-ylidene)-dimethyl-ammonium chloride
CAS Name: (7-amino-3-phenothiazinylidene)-dimethylammonium chloride
IUPAC NAME: (7-aminophenothiazin-3-ylidene)-dimethylazanium chloride
SYSTEMATIC NAME: (7-azanylphenothiazin-3-ylidene)-dimethyl-azanium chloride
MOLECULAR FORMULA: C14H14ClN3S
MOLECULAR WEIGHT: 291.79906
SMILES: C[N+](=C1C=CC2=NC3=C(C=C(C=C3)N)SC2=C1)C.[Cl-]
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Product OPENEYE NAME: (7-aminophenothiazin-3-ylidene)-dimethyl-ammonium
CAS Name: (7-amino-3-phenothiazinylidene)-dimethylammonium
IUPAC NAME: (7-aminophenothiazin-3-ylidene)-dimethylazanium
SYSTEMATIC NAME: (7-azanylphenothiazin-3-ylidene)-dimethyl-azanium
MOLECULAR FORMULA: C14H14N3S+
MOLECULAR WEIGHT: 256.34606
SMILES: C[N+](=C1C=CC2=NC3=C(C=C(C=C3)N)SC2=C1)C
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Product OPENEYE NAME: 2-(4-phenylphenyl)butanoic acid
CAS Name: 2-(4-phenylphenyl)butanoic acid
IUPAC NAME: 2-(4-phenylphenyl)butanoic acid
SYSTEMATIC NAME: 2-(4-phenylphenyl)butanoic acid
MOLECULAR FORMULA: C16H16O2
MOLECULAR WEIGHT: 240.29704
SMILES: CCC(C1=CC=C(C=C1)C2=CC=CC=C2)C(=O)O
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Product OPENEYE NAME: N,N-diethyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethanamine
CAS Name: N,N-diethyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethanamine
IUPAC NAME: N,N-diethyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethanamine
SYSTEMATIC NAME: N,N-diethyl-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethanamine
MOLECULAR FORMULA: C14H19N3O
MOLECULAR WEIGHT: 245.32016
SMILES: CCN(CC)CCC1=NC(=NO1)C2=CC=CC=C2
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Product OPENEYE NAME: bis(2-hydroxyethyl) benzene-1,4-dicarboxylate
CAS Name: benzene-1,4-dicarboxylic acid bis(2-hydroxyethyl) ester
IUPAC NAME: bis(2-hydroxyethyl) benzene-1,4-dicarboxylate
SYSTEMATIC NAME: bis(2-hydroxyethyl) benzene-1,4-dicarboxylate
MOLECULAR FORMULA: C12H14O6
MOLECULAR WEIGHT: 254.23596
SMILES: C1=CC(=CC=C1C(=O)OCCO)C(=O)OCCO
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Product OPENEYE NAME: benzyl-dimethyl-octyl-ammonium chloride
CAS Name: dimethyl-octyl-(phenylmethyl)ammonium chloride
IUPAC NAME: benzyl-dimethyl-octylazanium chloride
SYSTEMATIC NAME: dimethyl-octyl-(phenylmethyl)azanium chloride
MOLECULAR FORMULA: C17H30ClN
MOLECULAR WEIGHT: 283.8798
SMILES: CCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]
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Product OPENEYE NAME: benzyl-dimethyl-octyl-ammonium
CAS Name: dimethyl-octyl-(phenylmethyl)ammonium
IUPAC NAME: benzyl-dimethyl-octylazanium
SYSTEMATIC NAME: dimethyl-octyl-(phenylmethyl)azanium
MOLECULAR FORMULA: C17H30N+
MOLECULAR WEIGHT: 248.4268
SMILES: CCCCCCCC[N+](C)(C)CC1=CC=CC=C1
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Product OPENEYE NAME: 2,4,6-tris(2-chloroethoxy)-1,3,5-triazine
CAS Name: 2,4,6-tris(2-chloroethoxy)-1,3,5-triazine
IUPAC NAME: 2,4,6-tris(2-chloroethoxy)-1,3,5-triazine
SYSTEMATIC NAME: 2,4,6-tris(2-chloroethyloxy)-1,3,5-triazine
MOLECULAR FORMULA: C9H12Cl3N3O3
MOLECULAR WEIGHT: 316.56888
SMILES: C(CCl)OC1=NC(=NC(=N1)OCCCl)OCCCl
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Product OPENEYE NAME: 2-(5-butyl-2,4,6-trioxo-hexahydropyrimidin-5-yl)ethyl carbamate
CAS Name: carbamic acid 2-(5-butyl-2,4,6-trioxo-1,3-diazinan-5-yl)ethyl ester
IUPAC NAME: 2-(5-butyl-2,4,6-trioxo-1,3-diazinan-5-yl)ethyl carbamate
SYSTEMATIC NAME: 2-[5-butyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]ethyl carbamate
MOLECULAR FORMULA: C11H17N3O5
MOLECULAR WEIGHT: 271.26978
SMILES: CCCCC1(C(=O)NC(=O)NC1=O)CCOC(=O)N
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Product OPENEYE NAME: 2-amino-9-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-one
CAS Name: 2-amino-9-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-3H-purin-6-one
IUPAC NAME: 2-amino-9-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one
SYSTEMATIC NAME: 2-azanyl-9-[(4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one
MOLECULAR FORMULA: C10H13N5O4
MOLECULAR WEIGHT: 267.24132
SMILES: C1[C@@H]([C@H](OC1N2C=NC3=C2NC(=NC3=O)N)CO)O
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Product OPENEYE NAME: [2-chloro-1-(2,4,5-trichlorophenyl)vinyl] dimethyl phosphate
CAS Name: phosphoric acid [2-chloro-1-(2,4,5-trichlorophenyl)ethenyl] dimethyl ester
IUPAC NAME: [2-chloro-1-(2,4,5-trichlorophenyl)ethenyl] dimethyl phosphate
SYSTEMATIC NAME: [2-chloranyl-1-[2,4,5-tris(chloranyl)phenyl]ethenyl] dimethyl phosphate
MOLECULAR FORMULA: C10H9Cl4O4P
MOLECULAR WEIGHT: 365.961821
SMILES: COP(=O)(OC)OC(=CCl)C1=CC(=C(C=C1Cl)Cl)Cl
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Product OPENEYE NAME: 3-(dimethoxyphosphorylsulfanylmethyl)-1,2,3-benzotriazin-4-one
CAS Name: 3-[(dimethoxyphosphorylthio)methyl]-1,2,3-benzotriazin-4-one
IUPAC NAME: 3-(dimethoxyphosphorylsulfanylmethyl)-1,2,3-benzotriazin-4-one
SYSTEMATIC NAME: 3-(dimethoxyphosphorylsulfanylmethyl)-1,2,3-benzotriazin-4-one
MOLECULAR FORMULA: C10H12N3O4PS
MOLECULAR WEIGHT: 301.258741
SMILES: COP(=O)(OC)SCN1C(=O)C2=CC=CC=C2N=N1
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