Thursday, August 25, 2011

http://ChemLookup.com Compounds




CAS RN: 147636-76-8
CAS Name: 4-piperidinecarboxylic acid ethyl ester hydrochloride
OPENEYE Name: ethyl piperidine-4-carboxylate hydrochloride
IUPAC Name: ethyl piperidine-4-carboxylate hydrochloride
SYSTEMATIC NAME: ethyl piperidine-4-carboxylate hydrochloride
MOLECULAR FORMULA: C8H16ClNO2
MOLECULAR WEIGHT: 193.67114
SMILES: CCOC(=O)C1CCNCC1.Cl
Structure:

CAS RN: 185985-40-4
CAS Name: 2,3-dichloro-5-fluoropyridine
OPENEYE Name: 2,3-dichloro-5-fluoro-pyridine
IUPAC Name: 2,3-dichloro-5-fluoropyridine
SYSTEMATIC NAME: 2,3-bis(chloranyl)-5-fluoranyl-pyridine
MOLECULAR FORMULA: C5H2Cl2FN
MOLECULAR WEIGHT: 165.980483
SMILES: C1=C(C=NC(=C1Cl)Cl)F
Structure:

CAS RN: 83315-69-9
CAS Name: 3-azidopropyl(triethoxy)silane
OPENEYE Name: 3-azidopropyl(triethoxy)silane
IUPAC Name: 3-azidopropyl(triethoxy)silane
SYSTEMATIC NAME: 3-azidopropyl(triethoxy)silane
MOLECULAR FORMULA: C9H21N3O3Si
MOLECULAR WEIGHT: 247.36684
SMILES: CCO[Si](CCCN=[N+]=[N-])(OCC)OCC
Structure:

CAS RN: 52372-32-4
CAS Name: 2,5-diamino-2-methylpentanoic acid hydrochloride
OPENEYE Name: 2,5-diamino-2-methyl-pentanoic acid hydrochloride
IUPAC Name: 2,5-diamino-2-methylpentanoic acid hydrochloride
SYSTEMATIC NAME: 2,5-bis(azanyl)-2-methyl-pentanoic acid hydrochloride
MOLECULAR FORMULA: C6H15ClN2O2
MOLECULAR WEIGHT: 182.6485
SMILES: CC(CCCN)(C(=O)O)N.Cl
Structure:

CAS RN: 13465-88-8
CAS Name: silver oxido(oxo)borane
OPENEYE Name: silver oxido(oxo)borane
IUPAC Name: silver oxido(oxo)borane
SYSTEMATIC NAME: silver oxidanidyl(oxidanylidene)borane
MOLECULAR FORMULA: AgBO2
MOLECULAR WEIGHT: 150.678
SMILES: B(=O)[O-].[Ag+]
Structure:

CAS RN: 339539-94-5
CAS Name: 1,1,2-trimethylhydrazine dihydrochloride
OPENEYE Name: 1,1,2-trimethylhydrazine dihydrochloride
IUPAC Name: 1,1,2-trimethylhydrazine dihydrochloride
SYSTEMATIC NAME: 1,1,2-trimethyldiazane dihydrochloride
MOLECULAR FORMULA: C3H12Cl2N2
MOLECULAR WEIGHT: 147.04678
SMILES: CNN(C)C.Cl.Cl
Structure:

CAS RN: 20662-14-0
CAS Name: scandium(3+) trichloride hexahydrate
OPENEYE Name: scandium(3+) trichloride hexahydrate
IUPAC Name: scandium(3+) trichloride hexahydrate
SYSTEMATIC NAME: scandium(3+) trichloride hexahydrate
MOLECULAR FORMULA: Cl3H12O6Sc
MOLECULAR WEIGHT: 259.40659
SMILES: O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Sc+3]
Structure:

CAS RN: 94226-20-7
CAS Name: 2-bromothieno[3,2-c]pyridine
OPENEYE Name: 2-bromothieno[3,2-c]pyridine
IUPAC Name: 2-bromothieno[3,2-c]pyridine
SYSTEMATIC NAME: 2-bromanylthieno[3,2-c]pyridine
MOLECULAR FORMULA: C7H4BrNS
MOLECULAR WEIGHT: 214.08236
SMILES: C1=CN=CC2=C1SC(=C2)Br
Structure:

CAS RN: 63330-57-4
CAS Name: 4-chloro-1,3-benzothiazol-2-amine hydrochloride
OPENEYE Name: 4-chloro-1,3-benzothiazol-2-amine hydrochloride
IUPAC Name: 4-chloro-1,3-benzothiazol-2-amine hydrochloride
SYSTEMATIC NAME: 4-chloranyl-1,3-benzothiazol-2-amine hydrochloride
MOLECULAR FORMULA: C7H6Cl2N2S
MOLECULAR WEIGHT: 221.10694
SMILES: C1=CC2=C(C(=C1)Cl)N=C(S2)N.Cl
Structure:

CAS RN: 3855-95-6
CAS Name: 2-chloro-1,3-benzothiazole-6-carboxylic acid
OPENEYE Name: 2-chloro-1,3-benzothiazole-6-carboxylic acid
IUPAC Name: 2-chloro-1,3-benzothiazole-6-carboxylic acid
SYSTEMATIC NAME: 2-chloranyl-1,3-benzothiazole-6-carboxylic acid
MOLECULAR FORMULA: C8H4ClNO2S
MOLECULAR WEIGHT: 213.64086
SMILES: C1=CC2=C(C=C1C(=O)O)SC(=N2)Cl
Structure:

CAS RN: 6293-61-4
CAS Name: bis(3-nitrophenyl)iodonium; hydrogen sulfate
OPENEYE Name: bis(3-nitrophenyl)iodonium; hydrogen sulfate
IUPAC Name: bis(3-nitrophenyl)iodanium; hydrogen sulfate
SYSTEMATIC NAME: bis(3-nitrophenyl)iodanium; hydrogen sulfate
MOLECULAR FORMULA: C12H9IN2O8S
MOLECULAR WEIGHT: 468.17793
SMILES: C1=CC(=CC(=C1)[I+]C2=CC=CC(=C2)[N+](=O)[O-])[N+](=O)[O-].OS(=O)(=O)[O-]
Structure:

CAS RN: 151860-17-2
CAS Name: 3-(phenylmethyl)-3-azabicyclo[3.1.0]hexan-6-amine
OPENEYE Name: 3-benzyl-3-azabicyclo[3.1.0]hexan-6-amine
IUPAC Name: 3-benzyl-3-azabicyclo[3.1.0]hexan-6-amine
SYSTEMATIC NAME: 3-(phenylmethyl)-3-azabicyclo[3.1.0]hexan-6-amine
MOLECULAR FORMULA: C12H16N2
MOLECULAR WEIGHT: 188.26884
SMILES: C1C2C(C2N)CN1CC3=CC=CC=C3
Structure:

CAS RN: 55791-52-1
CAS Name: 1-(chloromethyl)-2,4-dimethoxybenzene
OPENEYE Name: 1-(chloromethyl)-2,4-dimethoxy-benzene
IUPAC Name: 1-(chloromethyl)-2,4-dimethoxybenzene
SYSTEMATIC NAME: 1-(chloromethyl)-2,4-dimethoxy-benzene
MOLECULAR FORMULA: C9H11ClO2
MOLECULAR WEIGHT: 186.63544
SMILES: COC1=CC(=C(C=C1)CCl)OC
Structure:

CAS RN: 101084-95-1
CAS Name: 2-amino-1,3-benzothiazole-5-carboxylic acid
OPENEYE Name: 2-amino-1,3-benzothiazole-5-carboxylic acid
IUPAC Name: 2-amino-1,3-benzothiazole-5-carboxylic acid
SYSTEMATIC NAME: 2-azanyl-1,3-benzothiazole-5-carboxylic acid
MOLECULAR FORMULA: C8H6N2O2S
MOLECULAR WEIGHT: 194.21044
SMILES: C1=CC2=C(C=C1C(=O)O)N=C(S2)N
Structure:

CAS RN: 394223-15-5
CAS Name: 1,2,3-benzothiadiazole-5-carboxaldehyde
OPENEYE Name: 1,2,3-benzothiadiazole-5-carbaldehyde
IUPAC Name: 1,2,3-benzothiadiazole-5-carbaldehyde
SYSTEMATIC NAME: 1,2,3-benzothiadiazole-5-carbaldehyde
MOLECULAR FORMULA: C7H4N2OS
MOLECULAR WEIGHT: 164.18446
SMILES: C1=CC2=C(C=C1C=O)N=NS2
Structure:

CAS RN: 16897-56-6
CAS Name: 3,3a,4,5-tetrahydroacenaphthylene
OPENEYE Name: 3,3a,4,5-tetrahydroacenaphthylene
IUPAC Name: 3,3a,4,5-tetrahydroacenaphthylene
SYSTEMATIC NAME: 3,3a,4,5-tetrahydroacenaphthylene
MOLECULAR FORMULA: C12H12
MOLECULAR WEIGHT: 156.22368
SMILES: C1CC2C=CC3=C2C(=CC=C3)C1
Structure:

CAS RN: 5579-81-7
CAS Name: [4-(carbamoylamino)-5-oxo-1,4-dihydroimidazol-2-yl]oxyaluminum dihydrate
OPENEYE Name: (5-oxo-4-ureido-1,4-dihydroimidazol-2-yl)oxyaluminum dihydrate
IUPAC Name: [4-(carbamoylamino)-5-oxo-1,4-dihydroimidazol-2-yl]oxyaluminum dihydrate
SYSTEMATIC NAME: [4-(aminocarbonylamino)-5-oxidanylidene-1,4-dihydroimidazol-2-yl]oxyaluminum dihydrate
MOLECULAR FORMULA: C4H9AlN4O5
MOLECULAR WEIGHT: 220.119598
SMILES: C1(C(=O)NC(=N1)O[Al])NC(=O)N.O.O
Structure:

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