Product OPENEYE NAME: 2-phenoxyethylhydrazine
CAS Name: 2-phenoxyethylhydrazine
IUPAC NAME: 2-phenoxyethylhydrazine
SYSTEMATIC NAME: 2-phenoxyethyldiazane
MOLECULAR FORMULA: C8H12N2O
MOLECULAR WEIGHT: 152.19368
SMILES: C1=CC=C(C=C1)OCCNN
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Product OPENEYE NAME: 1,7,7-trimethylnorbornane-2,5-dione
CAS Name: 4,7,7-trimethylbicyclo[2.2.1]heptane-2,5-dione
IUPAC NAME: 4,7,7-trimethylbicyclo[2.2.1]heptane-2,5-dione
SYSTEMATIC NAME: 4,7,7-trimethylbicyclo[2.2.1]heptane-2,5-dione
MOLECULAR FORMULA: C10H14O2
MOLECULAR WEIGHT: 166.21696
SMILES: CC1(C2CC(=O)C1(CC2=O)C)C
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Product OPENEYE NAME: allyl octanoate
CAS Name: octanoic acid prop-2-enyl ester
IUPAC NAME: prop-2-enyl octanoate
SYSTEMATIC NAME: prop-2-enyl octanoate
MOLECULAR FORMULA: C11H20O2
MOLECULAR WEIGHT: 184.2753
SMILES: CCCCCCCC(=O)OCC=C
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Product OPENEYE NAME: 5-[3-(dimethylamino)propyl]-11H-benzo[b][1,4]benzodiazepin-6-one
CAS Name: 5-[3-(dimethylamino)propyl]-11H-benzo[b][1,4]benzodiazepin-6-one
IUPAC NAME: 5-[3-(dimethylamino)propyl]-11H-benzo[b][1,4]benzodiazepin-6-one
SYSTEMATIC NAME: 5-[3-(dimethylamino)propyl]-11H-benzo[b][1,4]benzodiazepin-6-one
MOLECULAR FORMULA: C18H21N3O
MOLECULAR WEIGHT: 295.37884
SMILES: CN(C)CCCN1C2=CC=CC=C2NC3=CC=CC=C3C1=O
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Product OPENEYE NAME: 5-[3-(diethylamino)propyl]-11H-benzo[b][1,4]benzodiazepin-6-one
CAS Name: 5-[3-(diethylamino)propyl]-11H-benzo[b][1,4]benzodiazepin-6-one
IUPAC NAME: 5-[3-(diethylamino)propyl]-11H-benzo[b][1,4]benzodiazepin-6-one
SYSTEMATIC NAME: 5-[3-(diethylamino)propyl]-11H-benzo[b][1,4]benzodiazepin-6-one
MOLECULAR FORMULA: C20H25N3O
MOLECULAR WEIGHT: 323.432
SMILES: CCN(CC)CCCN1C2=CC=CC=C2NC3=CC=CC=C3C1=O
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Product OPENEYE NAME: 4-[2-(ethylamino)-1-hydroxy-ethyl]phenol
CAS Name: 4-[2-(ethylamino)-1-hydroxyethyl]phenol
IUPAC NAME: 4-[2-(ethylamino)-1-hydroxyethyl]phenol
SYSTEMATIC NAME: 4-[2-(ethylamino)-1-oxidanyl-ethyl]phenol
MOLECULAR FORMULA: C10H15NO2
MOLECULAR WEIGHT: 181.2316
SMILES: CCNCC(C1=CC=C(C=C1)O)O
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Product OPENEYE NAME: 4-[1-hydroxy-2-(propylamino)ethyl]phenol
CAS Name: 4-[1-hydroxy-2-(propylamino)ethyl]phenol
IUPAC NAME: 4-[1-hydroxy-2-(propylamino)ethyl]phenol
SYSTEMATIC NAME: 4-[1-oxidanyl-2-(propylamino)ethyl]phenol
MOLECULAR FORMULA: C11H17NO2
MOLECULAR WEIGHT: 195.25818
SMILES: CCCNCC(C1=CC=C(C=C1)O)O
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Product OPENEYE NAME: (2,4-dinitrophenyl) acetate
CAS Name: acetic acid (2,4-dinitrophenyl) ester
IUPAC NAME: (2,4-dinitrophenyl) acetate
SYSTEMATIC NAME: (2,4-dinitrophenyl) ethanoate
MOLECULAR FORMULA: C8H6N2O6
MOLECULAR WEIGHT: 226.14304
SMILES: CC(=O)OC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: (1-acetoxy-16-hydroxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl) acetate
CAS Name: acetic acid (1-acetyloxy-16-hydroxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl) ester
IUPAC NAME: (1-acetyloxy-16-hydroxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl) acetate
SYSTEMATIC NAME: (1-acetyloxy-13-methyl-16-oxidanyl-17-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl) ethanoate
MOLECULAR FORMULA: C22H26O6
MOLECULAR WEIGHT: 386.43824
SMILES: CC(=O)OC1=CC(=C2C3CCC4(C(C3CCC2=C1)CC(C4=O)O)C)OC(=O)C
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H12Cl10O4
MOLECULAR WEIGHT: 634.80478
SMILES: CCOC(=O)CCC(=O)CC1(C2(C3(C4(C1(C5(C2(C3(C(C45Cl)(Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)O
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Product OPENEYE NAME: N-(9-phenanthryl)acetamide
CAS Name: N-(9-phenanthrenyl)acetamide
IUPAC NAME: N-phenanthren-9-ylacetamide
SYSTEMATIC NAME: N-phenanthren-9-ylethanamide
MOLECULAR FORMULA: C16H13NO
MOLECULAR WEIGHT: 235.28052
SMILES: CC(=O)NC1=CC2=CC=CC=C2C3=CC=CC=C31
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Product OPENEYE NAME: 3-[4-[2-chloroethyl(2-fluoroethyl)amino]phenyl]propanoic acid
CAS Name: 3-[4-[2-chloroethyl(2-fluoroethyl)amino]phenyl]propanoic acid
IUPAC NAME: 3-[4-[2-chloroethyl(2-fluoroethyl)amino]phenyl]propanoic acid
SYSTEMATIC NAME: 3-[4-[2-chloroethyl(2-fluoranylethyl)amino]phenyl]propanoic acid
MOLECULAR FORMULA: C13H17ClFNO2
MOLECULAR WEIGHT: 273.730983
SMILES: C1=CC(=CC=C1CCC(=O)O)N(CCF)CCCl
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Product OPENEYE NAME: 2-methoxyethyl(trimethyl)ammonium iodide
CAS Name: 2-methoxyethyl(trimethyl)ammonium iodide
IUPAC NAME: 2-methoxyethyl(trimethyl)azanium iodide
SYSTEMATIC NAME: 2-methoxyethyl(trimethyl)azanium iodide
MOLECULAR FORMULA: C6H16INO
MOLECULAR WEIGHT: 245.10181
SMILES: C[N+](C)(C)CCOC.[I-]
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Product OPENEYE NAME: 2-methoxyethyl(trimethyl)ammonium
CAS Name: 2-methoxyethyl(trimethyl)ammonium
IUPAC NAME: 2-methoxyethyl(trimethyl)azanium
SYSTEMATIC NAME: 2-methoxyethyl(trimethyl)azanium
MOLECULAR FORMULA: C6H16NO+
MOLECULAR WEIGHT: 118.19734
SMILES: C[N+](C)(C)CCOC
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Product OPENEYE NAME: 6-methyl-2-oxo-5-phenyl-1H-pyridine-3-carbonitrile
CAS Name: 6-methyl-2-oxo-5-phenyl-1H-pyridine-3-carbonitrile
IUPAC NAME: 6-methyl-2-oxo-5-phenyl-1H-pyridine-3-carbonitrile
SYSTEMATIC NAME: 6-methyl-2-oxidanylidene-5-phenyl-1H-pyridine-3-carbonitrile
MOLECULAR FORMULA: C13H10N2O
MOLECULAR WEIGHT: 210.2313
SMILES: CC1=C(C=C(C(=O)N1)C#N)C2=CC=CC=C2
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Product OPENEYE NAME: 2-fluoroethyl 2-(4-nitrophenyl)acetate
CAS Name: 2-(4-nitrophenyl)acetic acid 2-fluoroethyl ester
IUPAC NAME: 2-fluoroethyl 2-(4-nitrophenyl)acetate
SYSTEMATIC NAME: 2-fluoranylethyl 2-(4-nitrophenyl)ethanoate
MOLECULAR FORMULA: C10H10FNO4
MOLECULAR WEIGHT: 227.189103
SMILES: C1=CC(=CC=C1CC(=O)OCCF)[N+](=O)[O-]
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Product OPENEYE NAME: 2-fluoroethyl 2,2-diphenylacetate
CAS Name: 2,2-diphenylacetic acid 2-fluoroethyl ester
IUPAC NAME: 2-fluoroethyl 2,2-diphenylacetate
SYSTEMATIC NAME: 2-fluoranylethyl 2,2-diphenylethanoate
MOLECULAR FORMULA: C16H15FO2
MOLECULAR WEIGHT: 258.287503
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)OCCF
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Product OPENEYE NAME: 2-fluoroethyl 2-(4-methoxyphenyl)acetate
CAS Name: 2-(4-methoxyphenyl)acetic acid 2-fluoroethyl ester
IUPAC NAME: 2-fluoroethyl 2-(4-methoxyphenyl)acetate
SYSTEMATIC NAME: 2-fluoranylethyl 2-(4-methoxyphenyl)ethanoate
MOLECULAR FORMULA: C11H13FO3
MOLECULAR WEIGHT: 212.217523
SMILES: COC1=CC=C(C=C1)CC(=O)OCCF
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Product OPENEYE NAME: N-(3-chlorophenyl)-N-methyl-nitrous amide
CAS Name: N-(3-chlorophenyl)-N-methylnitrous amide
IUPAC NAME: N-(3-chlorophenyl)-N-methylnitrous amide
SYSTEMATIC NAME: N-(3-chlorophenyl)-N-methyl-nitrous amide
MOLECULAR FORMULA: C7H7ClN2O
MOLECULAR WEIGHT: 170.59628
SMILES: CN(C1=CC(=CC=C1)Cl)N=O
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Product OPENEYE NAME: 2-methyl-1-nitro-guanidine
CAS Name: 2-methyl-1-nitroguanidine
IUPAC NAME: 2-methyl-1-nitroguanidine
SYSTEMATIC NAME: 2-methyl-1-nitro-guanidine
MOLECULAR FORMULA: C2H6N4O2
MOLECULAR WEIGHT: 118.09464
SMILES: CN=C(N)N[N+](=O)[O-]
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Product OPENEYE NAME: 1-ethyl-2-nitro-1-nitroso-guanidine
CAS Name: 1-ethyl-2-nitro-1-nitrosoguanidine
IUPAC NAME: 1-ethyl-2-nitro-1-nitrosoguanidine
SYSTEMATIC NAME: 1-ethyl-2-nitro-1-nitroso-guanidine
MOLECULAR FORMULA: C3H7N5O3
MOLECULAR WEIGHT: 161.11938
SMILES: CCN(C(=N[N+](=O)[O-])N)N=O
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Product OPENEYE NAME: 3-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]propan-1-amine
CAS Name: 3-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]-1-propanamine
IUPAC NAME: 3-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]propan-1-amine
SYSTEMATIC NAME: 3-[2-[2-(3-azanylpropoxy)ethoxy]ethoxy]propan-1-amine
MOLECULAR FORMULA: C10H24N2O3
MOLECULAR WEIGHT: 220.30916
SMILES: C(CN)COCCOCCOCCCN
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