Sunday, September 30, 2012

http://ChemLookup.com Compounds




CAS RN: 2248-30-8
CAS Name: 3-(4-fluorophenyl)-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(4-fluorophenyl)pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(4-fluorophenyl)pyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(4-fluorophenyl)pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C10H13ClFNO
MOLECULAR WEIGHT: 217.667723
SMILES: C1CNCC1(C2=CC=C(C=C2)F)O.Cl
Structure:

CAS RN: 2247-48-5
CAS Name: 2-(2-chlorophenyl)acetic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester hydrochloride
OPENEYE Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(2-chlorophenyl)acetate hydrochloride
IUPAC Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(2-chlorophenyl)acetate hydrochloride
SYSTEMATIC NAME: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(2-chlorophenyl)ethanoate hydrochloride
MOLECULAR FORMULA: C16H21Cl2NO2
MOLECULAR WEIGHT: 330.24944
SMILES: CN1C2CCC1CC(C2)OC(=O)CC3=CC=CC=C3Cl.Cl
Structure:

CAS RN: 2247-50-9
CAS Name: 2-(2-chlorophenyl)acetic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester hydrochloride
OPENEYE Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(2-chlorophenyl)acetate hydrochloride
IUPAC Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(2-chlorophenyl)acetate hydrochloride
SYSTEMATIC NAME: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(2-chlorophenyl)ethanoate hydrochloride
MOLECULAR FORMULA: C16H21Cl2NO2
MOLECULAR WEIGHT: 330.24944
SMILES: CN1C2CCC1CC(C2)OC(=O)CC3=CC=CC=C3Cl.Cl
Structure:

CAS RN: 2245-90-1
CAS Name: 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-8-ol hydrochloride
OPENEYE Name: 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-8-ol hydrochloride
IUPAC Name: 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-8-ol hydrochloride
SYSTEMATIC NAME: 6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-8-ol hydrochloride
MOLECULAR FORMULA: C11H16ClNO3
MOLECULAR WEIGHT: 245.70264
SMILES: COC1=C(C(=C2CNCCC2=C1)O)OC.Cl
Structure:

CAS RN: 2240-97-3
CAS Name: N,1-bis(3-methylphenyl)-1,2,4-triazol-4-ium-4-amine chloride
OPENEYE Name: N,1-bis(m-tolyl)-1,2,4-triazol-4-ium-4-amine chloride
IUPAC Name: N,1-bis(3-methylphenyl)-1,2,4-triazol-4-ium-4-amine chloride
SYSTEMATIC NAME: N,1-bis(3-methylphenyl)-1,2,4-triazol-4-ium-4-amine chloride
MOLECULAR FORMULA: C16H17ClN4
MOLECULAR WEIGHT: 300.78598
SMILES: CC1=CC(=CC=C1)N[N+]2=CN(N=C2)C3=CC=CC(=C3)C.[Cl-]
Structure:

CAS RN: 2240-96-2
CAS Name: N,1-bis(2-methylphenyl)-1,2,4-triazol-4-ium-4-amine chloride
OPENEYE Name: N,1-bis(o-tolyl)-1,2,4-triazol-4-ium-4-amine chloride
IUPAC Name: N,1-bis(2-methylphenyl)-1,2,4-triazol-4-ium-4-amine chloride
SYSTEMATIC NAME: N,1-bis(2-methylphenyl)-1,2,4-triazol-4-ium-4-amine chloride
MOLECULAR FORMULA: C16H17ClN4
MOLECULAR WEIGHT: 300.78598
SMILES: CC1=CC=CC=C1N[N+]2=CN(N=C2)C3=CC=CC=C3C.[Cl-]
Structure:

CAS RN: 2239-02-3
CAS Name: 1-(2-chlorophenyl)-4-[4-(3,4-dimethoxyphenoxy)butyl]piperazine
OPENEYE Name: 1-(2-chlorophenyl)-4-[4-(3,4-dimethoxyphenoxy)butyl]piperazine
IUPAC Name: 1-(2-chlorophenyl)-4-[4-(3,4-dimethoxyphenoxy)butyl]piperazine
SYSTEMATIC NAME: 1-(2-chlorophenyl)-4-[4-(3,4-dimethoxyphenoxy)butyl]piperazine
MOLECULAR FORMULA: C22H29ClN2O3
MOLECULAR WEIGHT: 404.93026
SMILES: COC1=C(C=C(C=C1)OCCCCN2CCN(CC2)C3=CC=CC=C3Cl)OC
Structure:

CAS RN: 2238-80-4
CAS Name: 1-(4-morpholinyl)-3-thiophen-2-yl-5-hexen-3-ol hydrochloride
OPENEYE Name: 1-morpholino-3-(2-thienyl)hex-5-en-3-ol hydrochloride
IUPAC Name: 1-morpholin-4-yl-3-thiophen-2-ylhex-5-en-3-ol hydrochloride
SYSTEMATIC NAME: 1-morpholin-4-yl-3-thiophen-2-yl-hex-5-en-3-ol hydrochloride
MOLECULAR FORMULA: C14H22ClNO2S
MOLECULAR WEIGHT: 303.84798
SMILES: C=CCC(CCN1CCOCC1)(C2=CC=CS2)O.Cl
Structure:

CAS RN: 2238-79-1
CAS Name: 3-(4-methylphenyl)-1-(4-morpholinyl)-5-hexen-3-ol hydrochloride
OPENEYE Name: 1-morpholino-3-(p-tolyl)hex-5-en-3-ol hydrochloride
IUPAC Name: 3-(4-methylphenyl)-1-morpholin-4-ylhex-5-en-3-ol hydrochloride
SYSTEMATIC NAME: 3-(4-methylphenyl)-1-morpholin-4-yl-hex-5-en-3-ol hydrochloride
MOLECULAR FORMULA: C17H26ClNO2
MOLECULAR WEIGHT: 311.84684
SMILES: CC1=CC=C(C=C1)C(CCN2CCOCC2)(CC=C)O.Cl
Structure:

CAS RN: 2238-78-0
CAS Name: 3-(4-chlorophenyl)-1-(4-morpholinyl)-5-hexen-3-ol hydrochloride
OPENEYE Name: 3-(4-chlorophenyl)-1-morpholino-hex-5-en-3-ol hydrochloride
IUPAC Name: 3-(4-chlorophenyl)-1-morpholin-4-ylhex-5-en-3-ol hydrochloride
SYSTEMATIC NAME: 3-(4-chlorophenyl)-1-morpholin-4-yl-hex-5-en-3-ol hydrochloride
MOLECULAR FORMULA: C16H23Cl2NO2
MOLECULAR WEIGHT: 332.26532
SMILES: C=CCC(CCN1CCOCC1)(C2=CC=C(C=C2)Cl)O.Cl
Structure:

CAS RN: 2238-77-9
CAS Name: 1-phenyl-3-(4-prop-2-enyl-4-morpholin-4-iumyl)-1-thiophen-2-yl-1-propanol bromide
OPENEYE Name: 3-(4-allylmorpholin-4-ium-4-yl)-1-phenyl-1-(2-thienyl)propan-1-ol bromide
IUPAC Name: 1-phenyl-3-(4-prop-2-enylmorpholin-4-ium-4-yl)-1-thiophen-2-ylpropan-1-ol bromide
SYSTEMATIC NAME: 1-phenyl-3-(4-prop-2-enylmorpholin-4-ium-4-yl)-1-thiophen-2-yl-propan-1-ol bromide
MOLECULAR FORMULA: C20H26BrNO2S
MOLECULAR WEIGHT: 424.39494
SMILES: C=CC[N+]1(CCOCC1)CCC(C2=CC=CC=C2)(C3=CC=CS3)O.[Br-]
Structure:

CAS RN: 2233-93-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C25H25NO2
MOLECULAR WEIGHT: 371.4715
SMILES: COC1=C(C2=C3[C@@H](CC4=CC=CC=C42)N(CCC3=C1)CC5=CC=CC=C5)OC
Structure:

CAS RN: 2232-12-4
CAS Name: 1,3-diiodo-5,5-dimethylimidazolidine-2,4-dione
OPENEYE Name: 1,3-diiodo-5,5-dimethyl-imidazolidine-2,4-dione
IUPAC Name: 1,3-diiodo-5,5-dimethylimidazolidine-2,4-dione
SYSTEMATIC NAME: 1,3-bis(iodanyl)-5,5-dimethyl-imidazolidine-2,4-dione
MOLECULAR FORMULA: C5H6I2N2O2
MOLECULAR WEIGHT: 379.92228
SMILES: CC1(C(=O)N(C(=O)N1I)I)C
Structure:

CAS RN: 2232-02-2
CAS Name: 1-(2-chlorophenyl)-4-(2-phenoxyethyl)piperazine
OPENEYE Name: 1-(2-chlorophenyl)-4-(2-phenoxyethyl)piperazine
IUPAC Name: 1-(2-chlorophenyl)-4-(2-phenoxyethyl)piperazine
SYSTEMATIC NAME: 1-(2-chlorophenyl)-4-(2-phenoxyethyl)piperazine
MOLECULAR FORMULA: C18H21ClN2O
MOLECULAR WEIGHT: 316.82514
SMILES: C1CN(CCN1CCOC2=CC=CC=C2)C3=CC=CC=C3Cl
Structure:

CAS RN: 2231-49-4
CAS Name: 1-[4-(4-chlorophenoxy)butyl]-4-(4-chlorophenyl)piperazine
OPENEYE Name: 1-[4-(4-chlorophenoxy)butyl]-4-(4-chlorophenyl)piperazine
IUPAC Name: 1-[4-(4-chlorophenoxy)butyl]-4-(4-chlorophenyl)piperazine
SYSTEMATIC NAME: 1-[4-(4-chloranylphenoxy)butyl]-4-(4-chlorophenyl)piperazine
MOLECULAR FORMULA: C20H24Cl2N2O
MOLECULAR WEIGHT: 379.32336
SMILES: C1CN(CCN1CCCCOC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl
Structure:

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