Sunday, March 25, 2012

http://ChemLookup.com Compounds




CAS RN: 56926-38-6
CAS Name: 6-cyclohexyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid
OPENEYE Name: 6-cyclohexylchromane-2-carboxylic acid
IUPAC Name: 6-cyclohexyl-3,4-dihydro-2H-chromene-2-carboxylic acid
SYSTEMATIC NAME: 6-cyclohexyl-3,4-dihydro-2H-chromene-2-carboxylic acid
MOLECULAR FORMULA: C16H20O3
MOLECULAR WEIGHT: 260.3282
SMILES: C1CCC(CC1)C2=CC3=C(C=C2)OC(CC3)C(=O)O
Structure:

CAS RN: 56908-81-7
CAS Name: 1,2,3,4,5-pentamethylnaphthalene
OPENEYE Name: 1,2,3,4,5-pentamethylnaphthalene
IUPAC Name: 1,2,3,4,5-pentamethylnaphthalene
SYSTEMATIC NAME: 1,2,3,4,5-pentamethylnaphthalene
MOLECULAR FORMULA: C15H18
MOLECULAR WEIGHT: 198.30342
SMILES: CC1=CC=CC2=C1C(=C(C(=C2C)C)C)C
Structure:

CAS RN: 56896-76-5
CAS Name: 6-methyl-1,3-benzothiazol-2-amine hydrochloride
OPENEYE Name: 6-methyl-1,3-benzothiazol-2-amine hydrochloride
IUPAC Name: 6-methyl-1,3-benzothiazol-2-amine hydrochloride
SYSTEMATIC NAME: 6-methyl-1,3-benzothiazol-2-amine hydrochloride
MOLECULAR FORMULA: C8H9ClN2S
MOLECULAR WEIGHT: 200.68846
SMILES: CC1=CC2=C(C=C1)N=C(S2)N.Cl
Structure:

CAS RN: 56824-22-7
CAS Name: 2-(2-chloroethyl)-1-methylpyrrolidine hydrochloride
OPENEYE Name: 2-(2-chloroethyl)-1-methyl-pyrrolidine hydrochloride
IUPAC Name: 2-(2-chloroethyl)-1-methylpyrrolidine hydrochloride
SYSTEMATIC NAME: 2-(2-chloroethyl)-1-methyl-pyrrolidine hydrochloride
MOLECULAR FORMULA: C7H15Cl2N
MOLECULAR WEIGHT: 184.1067
SMILES: CN1CCCC1CCCl.Cl
Structure:

CAS RN: 56784-19-1
CAS Name: 3-acetyl-5-butan-2-yl-1-nitrosopyrrolidine-2,4-dione
OPENEYE Name: 3-acetyl-1-nitroso-5-sec-butyl-pyrrolidine-2,4-dione
IUPAC Name: 3-acetyl-5-butan-2-yl-1-nitrosopyrrolidine-2,4-dione
SYSTEMATIC NAME: 5-butan-2-yl-3-ethanoyl-1-nitroso-pyrrolidine-2,4-dione
MOLECULAR FORMULA: C10H14N2O4
MOLECULAR WEIGHT: 226.22916
SMILES: CCC(C)C1C(=O)C(C(=O)N1N=O)C(=O)C
Structure:

CAS RN: 56776-55-7
CAS Name: 2-methyl-N-phenylbenzenesulfonamide
OPENEYE Name: 2-methyl-N-phenyl-benzenesulfonamide
IUPAC Name: 2-methyl-N-phenylbenzenesulfonamide
SYSTEMATIC NAME: 2-methyl-N-phenyl-benzenesulfonamide
MOLECULAR FORMULA: C13H13NO2S
MOLECULAR WEIGHT: 247.31282
SMILES: CC1=CC=CC=C1S(=O)(=O)NC2=CC=CC=C2
Structure:

CAS RN: 56776-54-6
CAS Name: N-butyl-2-ethylbenzamide
OPENEYE Name: N-butyl-2-ethyl-benzamide
IUPAC Name: N-butyl-2-ethylbenzamide
SYSTEMATIC NAME: N-butyl-2-ethyl-benzamide
MOLECULAR FORMULA: C13H19NO
MOLECULAR WEIGHT: 205.29606
SMILES: CCCCNC(=O)C1=CC=CC=C1CC
Structure:

CAS RN: 56776-52-4
CAS Name: 2-ethyl-N-(2-methylphenyl)benzamide
OPENEYE Name: 2-ethyl-N-(o-tolyl)benzamide
IUPAC Name: 2-ethyl-N-(2-methylphenyl)benzamide
SYSTEMATIC NAME: 2-ethyl-N-(2-methylphenyl)benzamide
MOLECULAR FORMULA: C16H17NO
MOLECULAR WEIGHT: 239.31228
SMILES: CCC1=CC=CC=C1C(=O)NC2=CC=CC=C2C
Structure:

CAS RN: 56776-51-3
CAS Name: 2-ethyl-N-phenylbenzamide
OPENEYE Name: 2-ethyl-N-phenyl-benzamide
IUPAC Name: 2-ethyl-N-phenylbenzamide
SYSTEMATIC NAME: 2-ethyl-N-phenyl-benzamide
MOLECULAR FORMULA: C15H15NO
MOLECULAR WEIGHT: 225.2857
SMILES: CCC1=CC=CC=C1C(=O)NC2=CC=CC=C2
Structure:

CAS RN: 56775-91-8
CAS Name: 3-pyridinecarboxylic acid 2-[2-(4-chlorophenoxy)-2-methyl-1-oxopropoxy]ethyl ester hydrochloride
OPENEYE Name: 2-[2-(4-chlorophenoxy)-2-methyl-propanoyl]oxyethyl pyridine-3-carboxylate hydrochloride
IUPAC Name: 2-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxyethyl pyridine-3-carboxylate hydrochloride
SYSTEMATIC NAME: 2-[2-(4-chloranylphenoxy)-2-methyl-propanoyl]oxyethyl pyridine-3-carboxylate hydrochloride
MOLECULAR FORMULA: C18H19Cl2NO5
MOLECULAR WEIGHT: 400.25316
SMILES: CC(C)(C(=O)OCCOC(=O)C1=CN=CC=C1)OC2=CC=C(C=C2)Cl.Cl
Structure:

CAS RN: 56742-57-5
CAS Name: bis(2-hydroxyethyl)-dimethylammonium hydroxide
OPENEYE Name: bis(2-hydroxyethyl)-dimethyl-ammonium hydroxide
IUPAC Name: bis(2-hydroxyethyl)-dimethylazanium hydroxide
SYSTEMATIC NAME: bis(2-hydroxyethyl)-dimethyl-azanium hydroxide
MOLECULAR FORMULA: C6H17NO3
MOLECULAR WEIGHT: 151.20408
SMILES: C[N+](C)(CCO)CCO.[OH-]
Structure:

CAS RN: 25705-52-6
CAS Name: 2-anilinoacetic acid hydrochloride
OPENEYE Name: 2-anilinoacetic acid hydrochloride
IUPAC Name: 2-anilinoacetic acid hydrochloride
SYSTEMATIC NAME: 2-phenylazanylethanoic acid hydrochloride
MOLECULAR FORMULA: C8H10ClNO2
MOLECULAR WEIGHT: 187.6235
SMILES: C1=CC=C(C=C1)NCC(=O)O.Cl
Structure:

CAS RN: 56676-71-2
CAS Name: 2-anilinoacetic acid hydrochloride
OPENEYE Name: 2-anilinoacetic acid hydrochloride
IUPAC Name: 2-anilinoacetic acid hydrochloride
SYSTEMATIC NAME: 2-phenylazanylethanoic acid hydrochloride
MOLECULAR FORMULA: C8H10ClNO2
MOLECULAR WEIGHT: 187.6235
SMILES: C1=CC=C(C=C1)NCC(=O)O.Cl
Structure:

CAS RN: 71849-99-5
CAS Name: 2-anilinoacetic acid hydrochloride
OPENEYE Name: 2-anilinoacetic acid hydrochloride
IUPAC Name: 2-anilinoacetic acid hydrochloride
SYSTEMATIC NAME: 2-phenylazanylethanoic acid hydrochloride
MOLECULAR FORMULA: C8H10ClNO2
MOLECULAR WEIGHT: 187.6235
SMILES: C1=CC=C(C=C1)NCC(=O)O.Cl
Structure:

CAS RN: 56527-76-5
CAS Name: N,N-dimethyl-4-nitroaniline hydrochloride
OPENEYE Name: N,N-dimethyl-4-nitro-aniline hydrochloride
IUPAC Name: N,N-dimethyl-4-nitroaniline hydrochloride
SYSTEMATIC NAME: N,N-dimethyl-4-nitro-aniline hydrochloride
MOLECULAR FORMULA: C8H11ClN2O2
MOLECULAR WEIGHT: 202.63814
SMILES: CN(C)C1=CC=C(C=C1)[N+](=O)[O-].Cl
Structure:

CAS RN: 56496-89-0
CAS Name: 2,6-dimethylbenzene-1,4-diamine dihydrochloride
OPENEYE Name: 2,6-dimethylbenzene-1,4-diamine dihydrochloride
IUPAC Name: 2,6-dimethylbenzene-1,4-diamine dihydrochloride
SYSTEMATIC NAME: 2,6-dimethylbenzene-1,4-diamine dihydrochloride
MOLECULAR FORMULA: C8H14Cl2N2
MOLECULAR WEIGHT: 209.11616
SMILES: CC1=CC(=CC(=C1N)C)N.Cl.Cl
Structure:

CAS RN: 56461-98-4
CAS Name: 2,6-dichloro-4-methylaniline
OPENEYE Name: 2,6-dichloro-4-methyl-aniline
IUPAC Name: 2,6-dichloro-4-methylaniline
SYSTEMATIC NAME: 2,6-bis(chloranyl)-4-methyl-aniline
MOLECULAR FORMULA: C7H7Cl2N
MOLECULAR WEIGHT: 176.04318
SMILES: CC1=CC(=C(C(=C1)Cl)N)Cl
Structure:

CAS RN: 56420-30-5
CAS Name: N,N-dicyclopentylnitrous amide
OPENEYE Name: N,N-dicyclopentylnitrous amide
IUPAC Name: N,N-dicyclopentylnitrous amide
SYSTEMATIC NAME: N,N-dicyclopentylnitrous amide
MOLECULAR FORMULA: C10H18N2O
MOLECULAR WEIGHT: 182.26272
SMILES: C1CCC(C1)N(C2CCCC2)N=O
Structure:

CAS RN: 56418-71-4
CAS Name: ammonium hydroxymethanesulfonate
OPENEYE Name: ammonium hydroxymethanesulfonate
IUPAC Name: azanium hydroxymethanesulfonate
SYSTEMATIC NAME: azanium oxidanylmethanesulfonate
MOLECULAR FORMULA: CH7NO4S
MOLECULAR WEIGHT: 129.13558
SMILES: C(O)S(=O)(=O)[O-].[NH4+]
Structure:

CAS RN: 56401-81-1
CAS Name: 1-chloro-N,N-diethylmethanesulfonamide
OPENEYE Name: 1-chloro-N,N-diethyl-methanesulfonamide
IUPAC Name: 1-chloro-N,N-diethylmethanesulfonamide
SYSTEMATIC NAME: 1-chloranyl-N,N-diethyl-methanesulfonamide
MOLECULAR FORMULA: C5H12ClNO2S
MOLECULAR WEIGHT: 185.67228
SMILES: CCN(CC)S(=O)(=O)CCl
Structure:

CAS RN: 56216-28-5
CAS Name: 2,6-dimethoxypyridine-3,5-diamine dihydrochloride
OPENEYE Name: 2,6-dimethoxypyridine-3,5-diamine dihydrochloride
IUPAC Name: 2,6-dimethoxypyridine-3,5-diamine dihydrochloride
SYSTEMATIC NAME: 2,6-dimethoxypyridine-3,5-diamine dihydrochloride
MOLECULAR FORMULA: C7H13Cl2N3O2
MOLECULAR WEIGHT: 242.10302
SMILES: COC1=C(C=C(C(=N1)OC)N)N.Cl.Cl
Structure:

CAS RN: 56120-26-4
CAS Name: N-[4-(2,4-dichlorophenoxy)phenyl]acetamide
OPENEYE Name: N-[4-(2,4-dichlorophenoxy)phenyl]acetamide
IUPAC Name: N-[4-(2,4-dichlorophenoxy)phenyl]acetamide
SYSTEMATIC NAME: N-[4-[2,4-bis(chloranyl)phenoxy]phenyl]ethanamide
MOLECULAR FORMULA: C14H11Cl2NO2
MOLECULAR WEIGHT: 296.14864
SMILES: CC(=O)NC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl
Structure:

CAS RN: 41202-32-8
CAS Name: 1-(2-chlorophenyl)piperazine hydrochloride
OPENEYE Name: 1-(2-chlorophenyl)piperazine hydrochloride
IUPAC Name: 1-(2-chlorophenyl)piperazine hydrochloride
SYSTEMATIC NAME: 1-(2-chlorophenyl)piperazine hydrochloride
MOLECULAR FORMULA: C10H14Cl2N2
MOLECULAR WEIGHT: 233.13756
SMILES: C1CN(CCN1)C2=CC=CC=C2Cl.Cl
Structure:

CAS RN: 76835-05-7
CAS Name: 1-(2-chlorophenyl)piperazine hydrochloride
OPENEYE Name: 1-(2-chlorophenyl)piperazine hydrochloride
IUPAC Name: 1-(2-chlorophenyl)piperazine hydrochloride
SYSTEMATIC NAME: 1-(2-chlorophenyl)piperazine hydrochloride
MOLECULAR FORMULA: C10H14Cl2N2
MOLECULAR WEIGHT: 233.13756
SMILES: C1CN(CCN1)C2=CC=CC=C2Cl.Cl
Structure:

CAS RN: 55974-33-9
CAS Name: 1-(2-chlorophenyl)piperazine hydrochloride
OPENEYE Name: 1-(2-chlorophenyl)piperazine hydrochloride
IUPAC Name: 1-(2-chlorophenyl)piperazine hydrochloride
SYSTEMATIC NAME: 1-(2-chlorophenyl)piperazine hydrochloride
MOLECULAR FORMULA: C10H14Cl2N2
MOLECULAR WEIGHT: 233.13756
SMILES: C1CN(CCN1)C2=CC=CC=C2Cl.Cl
Structure:

CAS RN: 55821-55-1
CAS Name: 3-(2,2-difluoroethenyl)-2,2-dimethyl-1-cyclopropanecarboxylic acid [5-(phenylmethyl)-3-furanyl]methyl ester
OPENEYE Name: (5-benzyl-3-furyl)methyl 3-(2,2-difluorovinyl)-2,2-dimethyl-cyclopropanecarboxylate
IUPAC Name: (5-benzylfuran-3-yl)methyl 3-(2,2-difluoroethenyl)-2,2-dimethylcyclopropane-1-carboxylate
SYSTEMATIC NAME: [5-(phenylmethyl)furan-3-yl]methyl 3-[2,2-bis(fluoranyl)ethenyl]-2,2-dimethyl-cyclopropane-1-carboxylate
MOLECULAR FORMULA: C20H20F2O3
MOLECULAR WEIGHT: 346.367806
SMILES: CC1(C(C1C(=O)OCC2=COC(=C2)CC3=CC=CC=C3)C=C(F)F)C
Structure:

CAS RN: 55814-44-3
CAS Name: 2-methyl-N-(3-octoxyphenyl)benzamide
OPENEYE Name: 2-methyl-N-(3-octoxyphenyl)benzamide
IUPAC Name: 2-methyl-N-(3-octoxyphenyl)benzamide
SYSTEMATIC NAME: 2-methyl-N-(3-octoxyphenyl)benzamide
MOLECULAR FORMULA: C22H29NO2
MOLECULAR WEIGHT: 339.47116
SMILES: CCCCCCCCOC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C
Structure:

CAS RN: 55814-43-2
CAS Name: 2-methyl-N-(3-pentoxyphenyl)benzamide
OPENEYE Name: 2-methyl-N-(3-pentoxyphenyl)benzamide
IUPAC Name: 2-methyl-N-(3-pentoxyphenyl)benzamide
SYSTEMATIC NAME: 2-methyl-N-(3-pentoxyphenyl)benzamide
MOLECULAR FORMULA: C19H23NO2
MOLECULAR WEIGHT: 297.39142
SMILES: CCCCCOC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C
Structure:

CAS RN: 55814-40-9
CAS Name: 2-methyl-N-(2-propan-2-yloxyphenyl)benzamide
OPENEYE Name: N-(2-isopropoxyphenyl)-2-methyl-benzamide
IUPAC Name: 2-methyl-N-(2-propan-2-yloxyphenyl)benzamide
SYSTEMATIC NAME: 2-methyl-N-(2-propan-2-yloxyphenyl)benzamide
MOLECULAR FORMULA: C17H19NO2
MOLECULAR WEIGHT: 269.33826
SMILES: CC1=CC=CC=C1C(=O)NC2=CC=CC=C2OC(C)C
Structure:

CAS RN: 55774-38-4
CAS Name: 3-ethyl-3-(4-hydroxy-3-methoxyphenyl)piperidine-2,6-dione
OPENEYE Name: 3-ethyl-3-(4-hydroxy-3-methoxy-phenyl)piperidine-2,6-dione
IUPAC Name: 3-ethyl-3-(4-hydroxy-3-methoxyphenyl)piperidine-2,6-dione
SYSTEMATIC NAME: 3-ethyl-3-(3-methoxy-4-oxidanyl-phenyl)piperidine-2,6-dione
MOLECULAR FORMULA: C14H17NO4
MOLECULAR WEIGHT: 263.28908
SMILES: CCC1(CCC(=O)NC1=O)C2=CC(=C(C=C2)O)OC
Structure:

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