Product OPENEYE NAME: 2-(1-methylpyrrolidin-1-ium-2-yl)ethyl 2-methoxy-2,2-diphenyl-acetate chloride
CAS Name: 2-methoxy-2,2-diphenylacetic acid 2-(1-methyl-2-pyrrolidin-1-iumyl)ethyl ester chloride
IUPAC NAME: 2-(1-methylpyrrolidin-1-ium-2-yl)ethyl 2-methoxy-2,2-diphenylacetate chloride
SYSTEMATIC NAME: 2-(1-methylpyrrolidin-1-ium-2-yl)ethyl 2-methoxy-2,2-diphenyl-ethanoate chloride
MOLECULAR FORMULA: C22H28ClNO3
MOLECULAR WEIGHT: 389.91562
SMILES: C[NH+]1CCCC1CCOC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)OC.[Cl-]
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Product OPENEYE NAME: 2-(1-methylpyrrolidin-2-yl)ethyl 2-methoxy-2,2-diphenyl-acetate
CAS Name: 2-methoxy-2,2-diphenylacetic acid 2-(1-methyl-2-pyrrolidinyl)ethyl ester
IUPAC NAME: 2-(1-methylpyrrolidin-2-yl)ethyl 2-methoxy-2,2-diphenylacetate
SYSTEMATIC NAME: 2-(1-methylpyrrolidin-2-yl)ethyl 2-methoxy-2,2-diphenyl-ethanoate
MOLECULAR FORMULA: C22H27NO3
MOLECULAR WEIGHT: 353.45468
SMILES: CN1CCCC1CCOC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)OC
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Product OPENEYE NAME: 2-(2-ethoxy-2,2-diphenyl-acetyl)oxyethyl-methyl-ammonium chloride
CAS Name: 2-(2-ethoxy-1-oxo-2,2-diphenylethoxy)ethyl-methylammonium chloride
IUPAC NAME: 2-(2-ethoxy-2,2-diphenylacetyl)oxyethyl-methylazanium chloride
SYSTEMATIC NAME: 2-(2-ethoxy-2,2-diphenyl-ethanoyl)oxyethyl-methyl-azanium chloride
MOLECULAR FORMULA: C19H24ClNO3
MOLECULAR WEIGHT: 349.85176
SMILES: CCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCC[NH2+]C.[Cl-]
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Product OPENEYE NAME: 2-(methylamino)ethyl 2-ethoxy-2,2-diphenyl-acetate
CAS Name: 2-ethoxy-2,2-diphenylacetic acid 2-(methylamino)ethyl ester
IUPAC NAME: 2-(methylamino)ethyl 2-ethoxy-2,2-diphenylacetate
SYSTEMATIC NAME: 2-(methylamino)ethyl 2-ethoxy-2,2-diphenyl-ethanoate
MOLECULAR FORMULA: C19H23NO3
MOLECULAR WEIGHT: 313.39082
SMILES: CCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCCNC
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Product OPENEYE NAME: ethyl-[2-(2-methoxy-2,2-diphenyl-acetyl)oxyethyl]-methyl-ammonium chloride
CAS Name: ethyl-[2-(2-methoxy-1-oxo-2,2-diphenylethoxy)ethyl]-methylammonium chloride
IUPAC NAME: ethyl-[2-(2-methoxy-2,2-diphenylacetyl)oxyethyl]-methylazanium chloride
SYSTEMATIC NAME: ethyl-[2-(2-methoxy-2,2-diphenyl-ethanoyl)oxyethyl]-methyl-azanium chloride
MOLECULAR FORMULA: C20H26ClNO3
MOLECULAR WEIGHT: 363.87834
SMILES: CC[NH+](C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)OC.[Cl-]
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Product OPENEYE NAME: 2-[ethyl(methyl)amino]ethyl 2-methoxy-2,2-diphenyl-acetate
CAS Name: 2-methoxy-2,2-diphenylacetic acid 2-[ethyl(methyl)amino]ethyl ester
IUPAC NAME: 2-[ethyl(methyl)amino]ethyl 2-methoxy-2,2-diphenylacetate
SYSTEMATIC NAME: 2-[ethyl(methyl)amino]ethyl 2-methoxy-2,2-diphenyl-ethanoate
MOLECULAR FORMULA: C20H25NO3
MOLECULAR WEIGHT: 327.4174
SMILES: CCN(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)OC
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Product OPENEYE NAME: 2-(2-ethoxy-2,2-diphenyl-acetyl)oxyethyl-ethyl-methyl-ammonium chloride
CAS Name: 2-(2-ethoxy-1-oxo-2,2-diphenylethoxy)ethyl-ethyl-methylammonium chloride
IUPAC NAME: 2-(2-ethoxy-2,2-diphenylacetyl)oxyethyl-ethyl-methylazanium chloride
SYSTEMATIC NAME: 2-(2-ethoxy-2,2-diphenyl-ethanoyl)oxyethyl-ethyl-methyl-azanium chloride
MOLECULAR FORMULA: C21H28ClNO3
MOLECULAR WEIGHT: 377.90492
SMILES: CC[NH+](C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)OCC.[Cl-]
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Product OPENEYE NAME: 2-[ethyl(methyl)amino]ethyl 2-ethoxy-2,2-diphenyl-acetate
CAS Name: 2-ethoxy-2,2-diphenylacetic acid 2-[ethyl(methyl)amino]ethyl ester
IUPAC NAME: 2-[ethyl(methyl)amino]ethyl 2-ethoxy-2,2-diphenylacetate
SYSTEMATIC NAME: 2-[ethyl(methyl)amino]ethyl 2-ethoxy-2,2-diphenyl-ethanoate
MOLECULAR FORMULA: C21H27NO3
MOLECULAR WEIGHT: 341.44398
SMILES: CCN(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)OCC
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Product OPENEYE NAME: isopropyl-[2-(2-methoxy-2,2-diphenyl-acetyl)oxyethyl]-methyl-ammonium chloride
CAS Name: 2-(2-methoxy-1-oxo-2,2-diphenylethoxy)ethyl-methyl-propan-2-ylammonium chloride
IUPAC NAME: 2-(2-methoxy-2,2-diphenylacetyl)oxyethyl-methyl-propan-2-ylazanium chloride
SYSTEMATIC NAME: 2-(2-methoxy-2,2-diphenyl-ethanoyl)oxyethyl-methyl-propan-2-yl-azanium chloride
MOLECULAR FORMULA: C21H28ClNO3
MOLECULAR WEIGHT: 377.90492
SMILES: CC(C)[NH+](C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)OC.[Cl-]
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Product OPENEYE NAME: 2-[isopropyl(methyl)amino]ethyl 2-methoxy-2,2-diphenyl-acetate
CAS Name: 2-methoxy-2,2-diphenylacetic acid 2-[methyl(propan-2-yl)amino]ethyl ester
IUPAC NAME: 2-[methyl(propan-2-yl)amino]ethyl 2-methoxy-2,2-diphenylacetate
SYSTEMATIC NAME: 2-[methyl(propan-2-yl)amino]ethyl 2-methoxy-2,2-diphenyl-ethanoate
MOLECULAR FORMULA: C21H27NO3
MOLECULAR WEIGHT: 341.44398
SMILES: CC(C)N(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)OC
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Product OPENEYE NAME: 2-(2-ethoxy-2,2-diphenyl-acetyl)oxyethyl-isopropyl-methyl-ammonium chloride
CAS Name: 2-(2-ethoxy-1-oxo-2,2-diphenylethoxy)ethyl-methyl-propan-2-ylammonium chloride
IUPAC NAME: 2-(2-ethoxy-2,2-diphenylacetyl)oxyethyl-methyl-propan-2-ylazanium chloride
SYSTEMATIC NAME: 2-(2-ethoxy-2,2-diphenyl-ethanoyl)oxyethyl-methyl-propan-2-yl-azanium chloride
MOLECULAR FORMULA: C22H30ClNO3
MOLECULAR WEIGHT: 391.9315
SMILES: CCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCC[NH+](C)C(C)C.[Cl-]
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Product OPENEYE NAME: 2-[isopropyl(methyl)amino]ethyl 2-ethoxy-2,2-diphenyl-acetate
CAS Name: 2-ethoxy-2,2-diphenylacetic acid 2-[methyl(propan-2-yl)amino]ethyl ester
IUPAC NAME: 2-[methyl(propan-2-yl)amino]ethyl 2-ethoxy-2,2-diphenylacetate
SYSTEMATIC NAME: 2-[methyl(propan-2-yl)amino]ethyl 2-ethoxy-2,2-diphenyl-ethanoate
MOLECULAR FORMULA: C22H29NO3
MOLECULAR WEIGHT: 355.47056
SMILES: CCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCCN(C)C(C)C
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C26H37FO6
MOLECULAR WEIGHT: 464.566783
SMILES: CC(=O)[C@@]12[C@@H](CC3C1(CC(C4C3C[C@@H](C5=CC(CCC45C)OC(=O)C)F)O)C)OC(O2)(C)C
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Product OPENEYE NAME: [(3S,9S,14S,17R)-17-acetoxy-17-acetyl-6-chloro-10,13-dimethyl-1,2,3,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-yl] acetate
CAS Name: acetic acid [(3S,9S,14S,17R)-17-acetyl-17-acetyloxy-6-chloro-10,13-dimethyl-1,2,3,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-yl] ester
IUPAC NAME: [(3S,9S,14S,17R)-17-acetyl-17-acetyloxy-6-chloro-10,13-dimethyl-1,2,3,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-yl] acetate
SYSTEMATIC NAME: [(3S,9S,14S,17R)-17-acetyloxy-6-chloranyl-17-ethanoyl-10,13-dimethyl-1,2,3,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-yl] ethanoate
MOLECULAR FORMULA: C25H33ClO5
MOLECULAR WEIGHT: 448.97952
SMILES: CC(=O)[C@]1(CC[C@@H]2C1(CC[C@H]3C2C=C(C4=C[C@H](CCC34C)OC(=O)C)Cl)C)OC(=O)C
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Product OPENEYE NAME: 2-(N-butylanilino)ethanol
CAS Name: 2-(N-butylanilino)ethanol
IUPAC NAME: 2-(N-butylanilino)ethanol
SYSTEMATIC NAME: 2-[butyl(phenyl)amino]ethanol
MOLECULAR FORMULA: C12H19NO
MOLECULAR WEIGHT: 193.28536
SMILES: CCCCN(CCO)C1=CC=CC=C1
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Product OPENEYE NAME: 4-methyl-1,3-benzothiazole
CAS Name: 4-methyl-1,3-benzothiazole
IUPAC NAME: 4-methyl-1,3-benzothiazole
SYSTEMATIC NAME: 4-methyl-1,3-benzothiazole
MOLECULAR FORMULA: C8H7NS
MOLECULAR WEIGHT: 149.21288
SMILES: CC1=C2C(=CC=C1)SC=N2
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Product OPENEYE NAME: 5-vinylbicyclo[2.2.1]hept-2-ene
CAS Name: 5-ethenylbicyclo[2.2.1]hept-2-ene
IUPAC NAME: 5-ethenylbicyclo[2.2.1]hept-2-ene
SYSTEMATIC NAME: 5-ethenylbicyclo[2.2.1]hept-2-ene
MOLECULAR FORMULA: C9H12
MOLECULAR WEIGHT: 120.19158
SMILES: C=CC1CC2CC1C=C2
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Product OPENEYE NAME: 2,7-dimethyl-3,8-dioxaspiro[4.4]nonane-4,9-dione
CAS Name: 2,7-dimethyl-3,8-dioxaspiro[4.4]nonane-4,9-dione
IUPAC NAME: 2,7-dimethyl-3,8-dioxaspiro[4.4]nonane-4,9-dione
SYSTEMATIC NAME: 2,7-dimethyl-3,8-dioxaspiro[4.4]nonane-4,9-dione
MOLECULAR FORMULA: C9H12O4
MOLECULAR WEIGHT: 184.18918
SMILES: CC1CC2(CC(OC2=O)C)C(=O)O1
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Product OPENEYE NAME: ammonium 2,4-dioxo-5-[(2,4,6-trioxohexahydropyrimidin-5-ylidene)amino]-1H-pyrimidin-6-olate
CAS Name: ammonium 2,4-dioxo-5-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)amino]-1H-pyrimidin-6-olate
IUPAC NAME: azanium 2,4-dioxo-5-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)amino]-1H-pyrimidin-6-olate
SYSTEMATIC NAME: azanium 2,4-bis(oxidanylidene)-5-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]amino]-1H-pyrimidin-6-olate
MOLECULAR FORMULA: C8H8N6O6
MOLECULAR WEIGHT: 284.18572
SMILES: C1(=C(NC(=O)NC1=O)[O-])N=C2C(=O)NC(=O)NC2=O.[NH4+]
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Product OPENEYE NAME: 5-[(6-hydroxy-2,4-dioxo-1H-pyrimidin-5-yl)imino]hexahydropyrimidine-2,4,6-trione
CAS Name: 5-[(6-hydroxy-2,4-dioxo-1H-pyrimidin-5-yl)imino]-1,3-diazinane-2,4,6-trione
IUPAC NAME: 5-[(6-hydroxy-2,4-dioxo-1H-pyrimidin-5-yl)imino]-1,3-diazinane-2,4,6-trione
SYSTEMATIC NAME: 5-[[6-oxidanyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]imino]-1,3-diazinane-2,4,6-trione
MOLECULAR FORMULA: C8H5N5O6
MOLECULAR WEIGHT: 267.1552
SMILES: C1(=C(NC(=O)NC1=O)O)N=C2C(=O)NC(=O)NC2=O
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Product OPENEYE NAME: 2-sulfododecanoic acid
CAS Name: 2-sulfododecanoic acid
IUPAC NAME: 2-sulfododecanoic acid
SYSTEMATIC NAME: 2-sulfododecanoic acid
MOLECULAR FORMULA: C12H24O5S
MOLECULAR WEIGHT: 280.38096
SMILES: CCCCCCCCCCC(C(=O)O)S(=O)(=O)O
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Product OPENEYE NAME: 2,3,4-trimethylpentan-2-ol
CAS Name: 2,3,4-trimethyl-2-pentanol
IUPAC NAME: 2,3,4-trimethylpentan-2-ol
SYSTEMATIC NAME: 2,3,4-trimethylpentan-2-ol
MOLECULAR FORMULA: C8H18O
MOLECULAR WEIGHT: 130.22792
SMILES: CC(C)C(C)C(C)(C)O
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