Wednesday, February 22, 2012

http://ChemLookup.com Compounds




CAS RN: 70842-06-7
CAS Name: 5,5-dimethyl-3-[3-(trifluoromethyl)phenyl]imidazolidine-2,4-dione
OPENEYE Name: 5,5-dimethyl-3-[3-(trifluoromethyl)phenyl]imidazolidine-2,4-dione
IUPAC Name: 5,5-dimethyl-3-[3-(trifluoromethyl)phenyl]imidazolidine-2,4-dione
SYSTEMATIC NAME: 5,5-dimethyl-3-[3-(trifluoromethyl)phenyl]imidazolidine-2,4-dione
MOLECULAR FORMULA: C12H11F3N2O2
MOLECULAR WEIGHT: 272.22315
SMILES: CC1(C(=O)N(C(=O)N1)C2=CC=CC(=C2)C(F)(F)F)C
Structure:

CAS RN: 70842-05-6
CAS Name: 3-[4-chloro-3-(trifluoromethyl)phenyl]-5,5-dimethylimidazolidine-2,4-dione
OPENEYE Name: 3-[4-chloro-3-(trifluoromethyl)phenyl]-5,5-dimethyl-imidazolidine-2,4-dione
IUPAC Name: 3-[4-chloro-3-(trifluoromethyl)phenyl]-5,5-dimethylimidazolidine-2,4-dione
SYSTEMATIC NAME: 3-[4-chloranyl-3-(trifluoromethyl)phenyl]-5,5-dimethyl-imidazolidine-2,4-dione
MOLECULAR FORMULA: C12H10ClF3N2O2
MOLECULAR WEIGHT: 306.66821
SMILES: CC1(C(=O)N(C(=O)N1)C2=CC(=C(C=C2)Cl)C(F)(F)F)C
Structure:

CAS RN: 70842-03-4
CAS Name: 3-(3-chloro-4-fluorophenyl)-5,5-dimethylimidazolidine-2,4-dione
OPENEYE Name: 3-(3-chloro-4-fluoro-phenyl)-5,5-dimethyl-imidazolidine-2,4-dione
IUPAC Name: 3-(3-chloro-4-fluorophenyl)-5,5-dimethylimidazolidine-2,4-dione
SYSTEMATIC NAME: 3-(3-chloranyl-4-fluoranyl-phenyl)-5,5-dimethyl-imidazolidine-2,4-dione
MOLECULAR FORMULA: C11H10ClFN2O2
MOLECULAR WEIGHT: 256.660703
SMILES: CC1(C(=O)N(C(=O)N1)C2=CC(=C(C=C2)F)Cl)C
Structure:

CAS RN: 70842-02-3
CAS Name: 2-[[[4-chloro-3-(trifluoromethyl)anilino]-oxomethyl]amino]-2-methylpropanoic acid methyl ester
OPENEYE Name: methyl 2-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methyl-propanoate
IUPAC Name: methyl 2-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methylpropanoate
SYSTEMATIC NAME: methyl 2-[[4-chloranyl-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methyl-propanoate
MOLECULAR FORMULA: C13H14ClF3N2O3
MOLECULAR WEIGHT: 338.71007
SMILES: CC(C)(C(=O)OC)NC(=O)NC1=CC(=C(C=C1)Cl)C(F)(F)F
Structure:

CAS RN: 70832-33-6
CAS Name: 4-[(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-hydroxymethyl]-6-quinolinol dihydrochloride
OPENEYE Name: 4-[hydroxy-(5-vinylquinuclidin-2-yl)methyl]quinolin-6-ol dihydrochloride
IUPAC Name: 4-[(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-hydroxymethyl]quinolin-6-ol dihydrochloride
SYSTEMATIC NAME: 4-[(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-oxidanyl-methyl]quinolin-6-ol dihydrochloride
MOLECULAR FORMULA: C19H24Cl2N2O2
MOLECULAR WEIGHT: 383.31206
SMILES: C=CC1CN2CCC1CC2C(C3=C4C=C(C=CC4=NC=C3)O)O.Cl.Cl
Structure:

CAS RN: 70829-93-5
CAS Name: 2-(2-furanylmethylamino)-5-(phenylmethyl)-1H-pyrimidine-4,6-dione
OPENEYE Name: 5-benzyl-2-(2-furylmethylamino)-1H-pyrimidine-4,6-dione
IUPAC Name: 5-benzyl-2-(furan-2-ylmethylamino)-1H-pyrimidine-4,6-dione
SYSTEMATIC NAME: 2-(furan-2-ylmethylamino)-5-(phenylmethyl)-1H-pyrimidine-4,6-dione
MOLECULAR FORMULA: C16H15N3O3
MOLECULAR WEIGHT: 297.3086
SMILES: C1=CC=C(C=C1)CC2C(=O)NC(=NC2=O)NCC3=CC=CO3
Structure:

CAS RN: 70796-21-3
CAS Name: 3-(4-chlorophenyl)-1-[2-(1-piperazinyl)ethyl]pyrrolidine-2,5-dione
OPENEYE Name: 3-(4-chlorophenyl)-1-(2-piperazin-1-ylethyl)pyrrolidine-2,5-dione
IUPAC Name: 3-(4-chlorophenyl)-1-(2-piperazin-1-ylethyl)pyrrolidine-2,5-dione
SYSTEMATIC NAME: 3-(4-chlorophenyl)-1-(2-piperazin-1-ylethyl)pyrrolidine-2,5-dione
MOLECULAR FORMULA: C16H20ClN3O2
MOLECULAR WEIGHT: 321.8019
SMILES: C1CN(CCN1)CCN2C(=O)CC(C2=O)C3=CC=C(C=C3)Cl
Structure:

CAS RN: 70796-20-2
CAS Name: 3-phenyl-1-[2-(1-piperazinyl)ethyl]pyrrolidine-2,5-dione
OPENEYE Name: 3-phenyl-1-(2-piperazin-1-ylethyl)pyrrolidine-2,5-dione
IUPAC Name: 3-phenyl-1-(2-piperazin-1-ylethyl)pyrrolidine-2,5-dione
SYSTEMATIC NAME: 3-phenyl-1-(2-piperazin-1-ylethyl)pyrrolidine-2,5-dione
MOLECULAR FORMULA: C16H21N3O2
MOLECULAR WEIGHT: 287.35684
SMILES: C1CN(CCN1)CCN2C(=O)CC(C2=O)C3=CC=CC=C3
Structure:

CAS RN: 70796-19-9
CAS Name: 2-[[2-(3-bromophenoxy)-1-oxoethyl]amino]-5-chlorobenzoic acid
OPENEYE Name: 2-[[2-(3-bromophenoxy)acetyl]amino]-5-chloro-benzoic acid
IUPAC Name: 2-[[2-(3-bromophenoxy)acetyl]amino]-5-chlorobenzoic acid
SYSTEMATIC NAME: 2-[2-(3-bromanylphenoxy)ethanoylamino]-5-chloranyl-benzoic acid
MOLECULAR FORMULA: C15H11BrClNO4
MOLECULAR WEIGHT: 384.60914
SMILES: C1=CC(=CC(=C1)Br)OCC(=O)NC2=C(C=C(C=C2)Cl)C(=O)O
Structure:

CAS RN: 70795-38-9
CAS Name: (8R,9S,10R,13S,14S)-17-ethynyl-17-methoxy-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
OPENEYE Name: (8R,9S,10R,13S,14S)-17-ethynyl-17-methoxy-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
IUPAC Name: (8R,9S,10R,13S,14S)-17-ethynyl-17-methoxy-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
SYSTEMATIC NAME: (8R,9S,10R,13S,14S)-17-ethynyl-17-methoxy-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
MOLECULAR FORMULA: C21H28O2
MOLECULAR WEIGHT: 312.44582
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2(C#C)OC)CCC4=CC(=O)CC[C@H]34
Structure:

CAS RN: 70786-40-2
CAS Name: 5-[2-(1-naphthalenyloxy)ethyl]-2H-tetrazole
OPENEYE Name: 5-[2-(1-naphthyloxy)ethyl]-2H-tetrazole
IUPAC Name: 5-(2-naphthalen-1-yloxyethyl)-2H-tetrazole
SYSTEMATIC NAME: 5-(2-naphthalen-1-yloxyethyl)-2H-1,2,3,4-tetrazole
MOLECULAR FORMULA: C13H12N4O
MOLECULAR WEIGHT: 240.26058
SMILES: C1=CC=C2C(=C1)C=CC=C2OCCC3=NNN=N3
Structure:

CAS RN: 70786-39-9
CAS Name: 5-[2-(2-methoxyphenoxy)ethyl]-2H-tetrazole
OPENEYE Name: 5-[2-(2-methoxyphenoxy)ethyl]-2H-tetrazole
IUPAC Name: 5-[2-(2-methoxyphenoxy)ethyl]-2H-tetrazole
SYSTEMATIC NAME: 5-[2-(2-methoxyphenoxy)ethyl]-2H-1,2,3,4-tetrazole
MOLECULAR FORMULA: C10H12N4O2
MOLECULAR WEIGHT: 220.22788
SMILES: COC1=CC=CC=C1OCCC2=NNN=N2
Structure:

CAS RN: 70786-38-8
CAS Name: 5-[2-(4-nitrophenoxy)ethyl]-2H-tetrazole
OPENEYE Name: 5-[2-(4-nitrophenoxy)ethyl]-2H-tetrazole
IUPAC Name: 5-[2-(4-nitrophenoxy)ethyl]-2H-tetrazole
SYSTEMATIC NAME: 5-[2-(4-nitrophenoxy)ethyl]-2H-1,2,3,4-tetrazole
MOLECULAR FORMULA: C9H9N5O3
MOLECULAR WEIGHT: 235.19946
SMILES: C1=CC(=CC=C1[N+](=O)[O-])OCCC2=NNN=N2
Structure:

CAS RN: 70786-37-7
CAS Name: 5-[2-(4-methylphenoxy)ethyl]-2H-tetrazole
OPENEYE Name: 5-[2-(4-methylphenoxy)ethyl]-2H-tetrazole
IUPAC Name: 5-[2-(4-methylphenoxy)ethyl]-2H-tetrazole
SYSTEMATIC NAME: 5-[2-(4-methylphenoxy)ethyl]-2H-1,2,3,4-tetrazole
MOLECULAR FORMULA: C10H12N4O
MOLECULAR WEIGHT: 204.22848
SMILES: CC1=CC=C(C=C1)OCCC2=NNN=N2
Structure:

CAS RN: 70786-36-6
CAS Name: 5-[2-(4-methoxyphenoxy)ethyl]-2H-tetrazole
OPENEYE Name: 5-[2-(4-methoxyphenoxy)ethyl]-2H-tetrazole
IUPAC Name: 5-[2-(4-methoxyphenoxy)ethyl]-2H-tetrazole
SYSTEMATIC NAME: 5-[2-(4-methoxyphenoxy)ethyl]-2H-1,2,3,4-tetrazole
MOLECULAR FORMULA: C10H12N4O2
MOLECULAR WEIGHT: 220.22788
SMILES: COC1=CC=C(C=C1)OCCC2=NNN=N2
Structure:

CAS RN: 70786-35-5
CAS Name: 5-(2-phenoxyethyl)-2H-tetrazole
OPENEYE Name: 5-(2-phenoxyethyl)-2H-tetrazole
IUPAC Name: 5-(2-phenoxyethyl)-2H-tetrazole
SYSTEMATIC NAME: 5-(2-phenoxyethyl)-2H-1,2,3,4-tetrazole
MOLECULAR FORMULA: C9H10N4O
MOLECULAR WEIGHT: 190.2019
SMILES: C1=CC=C(C=C1)OCCC2=NNN=N2
Structure:

CAS RN: 70786-33-3
CAS Name: 2-[1-(1-naphthalenyl)-5-tetrazolyl]acetamide
OPENEYE Name: 2-[1-(1-naphthyl)tetrazol-5-yl]acetamide
IUPAC Name: 2-(1-naphthalen-1-yltetrazol-5-yl)acetamide
SYSTEMATIC NAME: 2-(1-naphthalen-1-yl-1,2,3,4-tetrazol-5-yl)ethanamide
MOLECULAR FORMULA: C13H11N5O
MOLECULAR WEIGHT: 253.25934
SMILES: C1=CC=C2C(=C1)C=CC=C2N3C(=NN=N3)CC(=O)N
Structure:

CAS RN: 70786-32-2
CAS Name: 2-[1-(4-nitrophenyl)-5-tetrazolyl]acetamide
OPENEYE Name: 2-[1-(4-nitrophenyl)tetrazol-5-yl]acetamide
IUPAC Name: 2-[1-(4-nitrophenyl)tetrazol-5-yl]acetamide
SYSTEMATIC NAME: 2-[1-(4-nitrophenyl)-1,2,3,4-tetrazol-5-yl]ethanamide
MOLECULAR FORMULA: C9H8N6O3
MOLECULAR WEIGHT: 248.19822
SMILES: C1=CC(=CC=C1N2C(=NN=N2)CC(=O)N)[N+](=O)[O-]
Structure:

CAS RN: 70786-30-0
CAS Name: 2-[1-(4-chlorophenyl)-5-tetrazolyl]acetamide
OPENEYE Name: 2-[1-(4-chlorophenyl)tetrazol-5-yl]acetamide
IUPAC Name: 2-[1-(4-chlorophenyl)tetrazol-5-yl]acetamide
SYSTEMATIC NAME: 2-[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]ethanamide
MOLECULAR FORMULA: C9H8ClN5O
MOLECULAR WEIGHT: 237.64572
SMILES: C1=CC(=CC=C1N2C(=NN=N2)CC(=O)N)Cl
Structure:

CAS RN: 70786-28-6
CAS Name: 2-[1-(2-methylphenyl)-5-tetrazolyl]acetamide
OPENEYE Name: 2-[1-(o-tolyl)tetrazol-5-yl]acetamide
IUPAC Name: 2-[1-(2-methylphenyl)tetrazol-5-yl]acetamide
SYSTEMATIC NAME: 2-[1-(2-methylphenyl)-1,2,3,4-tetrazol-5-yl]ethanamide
MOLECULAR FORMULA: C10H11N5O
MOLECULAR WEIGHT: 217.22724
SMILES: CC1=CC=CC=C1N2C(=NN=N2)CC(=O)N
Structure:

CAS RN: 70786-26-4
CAS Name: 2-[1-(4-methylphenyl)-5-tetrazolyl]acetamide
OPENEYE Name: 2-[1-(p-tolyl)tetrazol-5-yl]acetamide
IUPAC Name: 2-[1-(4-methylphenyl)tetrazol-5-yl]acetamide
SYSTEMATIC NAME: 2-[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]ethanamide
MOLECULAR FORMULA: C10H11N5O
MOLECULAR WEIGHT: 217.22724
SMILES: CC1=CC=C(C=C1)N2C(=NN=N2)CC(=O)N
Structure:

CAS RN: 70780-59-5
CAS Name: 2-(1,3-dioxo-2-indenyl)-2-phenylethaneperoxoic acid ethyl ester
OPENEYE Name: ethyl 2-(1,3-dioxoindan-2-yl)-2-phenyl-peroxyacetate
IUPAC Name: ethyl 2-(1,3-dioxoinden-2-yl)-2-phenylethaneperoxoate
SYSTEMATIC NAME: ethyl 2-[1,3-bis(oxidanylidene)inden-2-yl]-2-phenyl-ethaneperoxoate
MOLECULAR FORMULA: C19H16O5
MOLECULAR WEIGHT: 324.32734
SMILES: CCOOC(=O)C(C1C(=O)C2=CC=CC=C2C1=O)C3=CC=CC=C3
Structure:

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