Product OPENEYE NAME: [3-benzoyloxy-2-(benzoyloxymethyl)-2-methyl-propyl] benzoate
CAS Name: benzoic acid [3-benzoyloxy-2-(benzoyloxymethyl)-2-methylpropyl] ester
IUPAC NAME: [3-benzoyloxy-2-(benzoyloxymethyl)-2-methylpropyl] benzoate
SYSTEMATIC NAME: [2-methyl-3-(phenylcarbonyloxy)-2-(phenylcarbonyloxymethyl)propyl] benzoate
MOLECULAR FORMULA: C26H24O6
MOLECULAR WEIGHT: 432.46516
SMILES: CC(COC(=O)C1=CC=CC=C1)(COC(=O)C2=CC=CC=C2)COC(=O)C3=CC=CC=C3
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Product OPENEYE NAME: (3-benzoyloxy-2,2-dimethyl-propyl) benzoate
CAS Name: benzoic acid (3-benzoyloxy-2,2-dimethylpropyl) ester
IUPAC NAME: (3-benzoyloxy-2,2-dimethylpropyl) benzoate
SYSTEMATIC NAME: [2,2-dimethyl-3-(phenylcarbonyloxy)propyl] benzoate
MOLECULAR FORMULA: C19H20O4
MOLECULAR WEIGHT: 312.3597
SMILES: CC(C)(COC(=O)C1=CC=CC=C1)COC(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 4-hydroxy-3,5-dimethyl-benzonitrile
CAS Name: 4-hydroxy-3,5-dimethylbenzonitrile
IUPAC NAME: 4-hydroxy-3,5-dimethylbenzonitrile
SYSTEMATIC NAME: 3,5-dimethyl-4-oxidanyl-benzenecarbonitrile
MOLECULAR FORMULA: C9H9NO
MOLECULAR WEIGHT: 147.17386
SMILES: CC1=CC(=CC(=C1O)C)C#N
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Product OPENEYE NAME: (2-aminoacetyl) 2-aminoacetate
CAS Name: 2-aminoacetic acid (2-amino-1-oxoethyl) ester
IUPAC NAME: (2-aminoacetyl) 2-aminoacetate
SYSTEMATIC NAME: 2-azanylethanoyl 2-azanylethanoate
MOLECULAR FORMULA: C4H8N2O3
MOLECULAR WEIGHT: 132.11792
SMILES: C(C(=O)OC(=O)CN)N
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C32H22N4O2
MOLECULAR WEIGHT: 494.54268
SMILES: CCN1C2=C3C(=CC(=CC3=N1)C4=CC5=NN(C6=C5C(=C4)C(=O)C7=CC=CC=C76)CC)C(=O)C8=CC=CC=C82
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Product OPENEYE NAME: N-(2,6-dichlorophenyl)-4,5-dihydro-1H-imidazol-2-amine hydrochloride
CAS Name: N-(2,6-dichlorophenyl)-4,5-dihydro-1H-imidazol-2-amine hydrochloride
IUPAC NAME: N-(2,6-dichlorophenyl)-4,5-dihydro-1H-imidazol-2-amine hydrochloride
SYSTEMATIC NAME: N-[2,6-bis(chloranyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine hydrochloride
MOLECULAR FORMULA: C9H10Cl3N3
MOLECULAR WEIGHT: 266.5548
SMILES: C1CN=C(N1)NC2=C(C=CC=C2Cl)Cl.Cl
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Product OPENEYE NAME: 3,7-bis(2-methoxyethyl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one
CAS Name: 3,7-bis(2-methoxyethyl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one
IUPAC NAME: 3,7-bis(2-methoxyethyl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one
SYSTEMATIC NAME: 3,7-bis(2-methoxyethyl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one
MOLECULAR FORMULA: C25H32N2O3
MOLECULAR WEIGHT: 408.53318
SMILES: COCCN1CC2(CN(CC(C1)(C2=O)C3=CC=CC=C3)CCOC)C4=CC=CC=C4
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Product OPENEYE NAME: 3,7-bis(3-methoxypropyl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one
CAS Name: 3,7-bis(3-methoxypropyl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one
IUPAC NAME: 3,7-bis(3-methoxypropyl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one
SYSTEMATIC NAME: 3,7-bis(3-methoxypropyl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one
MOLECULAR FORMULA: C27H36N2O3
MOLECULAR WEIGHT: 436.58634
SMILES: COCCCN1CC2(CN(CC(C1)(C2=O)C3=CC=CC=C3)CCCOC)C4=CC=CC=C4
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Product OPENEYE NAME: 3,7-bis(2-hydroxy-1,1-dimethyl-ethyl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one
CAS Name: 3,7-bis(1-hydroxy-2-methylpropan-2-yl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one
IUPAC NAME: 3,7-bis(1-hydroxy-2-methylpropan-2-yl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one
SYSTEMATIC NAME: 3,7-bis(2-methyl-1-oxidanyl-propan-2-yl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one
MOLECULAR FORMULA: C27H36N2O3
MOLECULAR WEIGHT: 436.58634
SMILES: CC(C)(CO)N1CC2(CN(CC(C1)(C2=O)C3=CC=CC=C3)C(C)(C)CO)C4=CC=CC=C4
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Product OPENEYE NAME: 2-[2-(4-chlorophenoxy)acetyl]oxyethyl-diethyl-ammonium chloride
CAS Name: 2-[2-(4-chlorophenoxy)-1-oxoethoxy]ethyl-diethylammonium chloride
IUPAC NAME: 2-[2-(4-chlorophenoxy)acetyl]oxyethyl-diethylazanium chloride
SYSTEMATIC NAME: 2-[2-(4-chloranylphenoxy)ethanoyloxy]ethyl-diethyl-azanium chloride
MOLECULAR FORMULA: C14H21Cl2NO3
MOLECULAR WEIGHT: 322.22744
SMILES: CC[NH+](CC)CCOC(=O)COC1=CC=C(C=C1)Cl.[Cl-]
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Product OPENEYE NAME: 2-(diethylamino)ethyl 2-(4-chlorophenoxy)acetate
CAS Name: 2-(4-chlorophenoxy)acetic acid 2-(diethylamino)ethyl ester
IUPAC NAME: 2-(diethylamino)ethyl 2-(4-chlorophenoxy)acetate
SYSTEMATIC NAME: 2-(diethylamino)ethyl 2-(4-chloranylphenoxy)ethanoate
MOLECULAR FORMULA: C14H20ClNO3
MOLECULAR WEIGHT: 285.7665
SMILES: CCN(CC)CCOC(=O)COC1=CC=C(C=C1)Cl
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Product OPENEYE NAME: 2-[[4-(6-methoxy-2-phenyl-3,4-dihydronaphthalen-1-yl)phenoxy]methyl]oxirane
CAS Name: 2-[[4-(6-methoxy-2-phenyl-3,4-dihydronaphthalen-1-yl)phenoxy]methyl]oxirane
IUPAC NAME: 2-[[4-(6-methoxy-2-phenyl-3,4-dihydronaphthalen-1-yl)phenoxy]methyl]oxirane
SYSTEMATIC NAME: 2-[[4-(6-methoxy-2-phenyl-3,4-dihydronaphthalen-1-yl)phenoxy]methyl]oxirane
MOLECULAR FORMULA: C26H24O3
MOLECULAR WEIGHT: 384.46696
SMILES: COC1=CC2=C(C=C1)C(=C(CC2)C3=CC=CC=C3)C4=CC=C(C=C4)OCC5CO5
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Product OPENEYE NAME: (N-isopropoxycarbonylanilino) acetate
CAS Name: acetic acid (N-[oxo(propan-2-yloxy)methyl]anilino) ester
IUPAC NAME: (N-propan-2-yloxycarbonylanilino) acetate
SYSTEMATIC NAME: [phenyl(propan-2-yloxycarbonyl)amino] ethanoate
MOLECULAR FORMULA: C12H15NO4
MOLECULAR WEIGHT: 237.2518
SMILES: CC(C)OC(=O)N(C1=CC=CC=C1)OC(=O)C
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Product OPENEYE NAME: 2-[[4-[bis(2-chloroethyl)amino]phenyl]methylene]propanedinitrile
CAS Name: 2-[[4-[bis(2-chloroethyl)amino]phenyl]methylidene]propanedinitrile
IUPAC NAME: 2-[[4-[bis(2-chloroethyl)amino]phenyl]methylidene]propanedinitrile
SYSTEMATIC NAME: 2-[[4-[bis(2-chloroethyl)amino]phenyl]methylidene]propanedinitrile
MOLECULAR FORMULA: C14H13Cl2N3
MOLECULAR WEIGHT: 294.17912
SMILES: C1=CC(=CC=C1C=C(C#N)C#N)N(CCCl)CCCl
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Product OPENEYE NAME: [(1R)-2-[4-[bis(2-chloroethyl)amino]phenyl]-1-carboxy-ethyl]ammonium chloride
CAS Name: [(1R)-2-[4-[bis(2-chloroethyl)amino]phenyl]-1-carboxyethyl]ammonium chloride
IUPAC NAME: [(1R)-2-[4-[bis(2-chloroethyl)amino]phenyl]-1-carboxyethyl]azanium chloride
SYSTEMATIC NAME: [(2R)-3-[4-[bis(2-chloroethyl)amino]phenyl]-1-oxidanyl-1-oxidanylidene-propan-2-yl]azanium chloride
MOLECULAR FORMULA: C13H19Cl3N2O2
MOLECULAR WEIGHT: 341.66116
SMILES: C1=CC(=CC=C1C[C@H](C(=O)O)[NH3+])N(CCCl)CCCl.[Cl-]
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Product OPENEYE NAME: (2R)-2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid
CAS Name: (2R)-2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid
IUPAC NAME: (2R)-2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid
SYSTEMATIC NAME: (2R)-2-azanyl-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid
MOLECULAR FORMULA: C13H18Cl2N2O2
MOLECULAR WEIGHT: 305.20022
SMILES: C1=CC(=CC=C1C[C@H](C(=O)O)N)N(CCCl)CCCl
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Product OPENEYE NAME: [2-[3-[bis(2-chloroethyl)amino]phenyl]-1-carboxy-ethyl]ammonium chloride
CAS Name: [2-[3-[bis(2-chloroethyl)amino]phenyl]-1-carboxyethyl]ammonium chloride
IUPAC NAME: [2-[3-[bis(2-chloroethyl)amino]phenyl]-1-carboxyethyl]azanium chloride
SYSTEMATIC NAME: [3-[3-[bis(2-chloroethyl)amino]phenyl]-1-oxidanyl-1-oxidanylidene-propan-2-yl]azanium chloride
MOLECULAR FORMULA: C13H19Cl3N2O2
MOLECULAR WEIGHT: 341.66116
SMILES: C1=CC(=CC(=C1)N(CCCl)CCCl)CC(C(=O)O)[NH3+].[Cl-]
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