Thursday, June 30, 2011

http://ChemLookup.com Compounds




CAS RN: 94139-14-7
CAS Name: acetic acid; 2-[2-hydroxyethyl(tetradecyl)amino]ethanol
OPENEYE Name: acetic acid; 2-[2-hydroxyethyl(tetradecyl)amino]ethanol
IUPAC Name: acetic acid; 2-[2-hydroxyethyl(tetradecyl)amino]ethanol
SYSTEMATIC NAME: ethanoic acid; 2-[2-hydroxyethyl(tetradecyl)amino]ethanol
MOLECULAR FORMULA: C20H43NO4
MOLECULAR WEIGHT: 361.55972
SMILES: CCCCCCCCCCCCCCN(CCO)CCO.CC(=O)O

CAS RN: 94087-51-1
CAS Name: tetrasodium 2-ethyl-N,N-bis(phosphonatomethyl)-1-hexanamine
OPENEYE Name: tetrasodium 2-ethyl-N,N-bis(phosphonatomethyl)hexan-1-amine
IUPAC Name: tetrasodium 2-ethyl-N,N-bis(phosphonatomethyl)hexan-1-amine
SYSTEMATIC NAME: tetrasodium 2-ethyl-N,N-bis(phosphonatomethyl)hexan-1-amine
MOLECULAR FORMULA: C10H21NNa4O6P2
MOLECULAR WEIGHT: 405.183442
SMILES: CCCCC(CC)CN(CP(=O)([O-])[O-])CP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]

CAS RN: 70028-80-7
CAS Name: [(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-[[(2R,3R,4R,5R)-3-[[(2R,3R,4S,5R)-3,4-dihydroxy-5-(phosphonooxymethyl)-2-oxolanyl]oxy]-4-hydroxy-5-(phosphonooxymethyl)-2-oxolanyl]oxy]-3-hydroxy-2-oxolanyl]methyl dihydrogen phosphate
OPENEYE Name: [(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-[(2R,3R,4R,5R)-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(phosphonooxymethyl)tetrahydrofuran-2-yl]oxy-4-hydroxy-5-(phosphonooxymethyl)tetrahydrofuran-2-yl]oxy-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
IUPAC Name: [(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-[(2R,3R,4R,5R)-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]oxy-4-hydroxy-5-(phosphonooxymethyl)oxolan-2-yl]oxy-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate
SYSTEMATIC NAME: [(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-[(2R,3R,4R,5R)-3-[(2R,3R,4S,5R)-3,4-bis(oxidanyl)-5-(phosphonooxymethyl)oxolan-2-yl]oxy-4-oxidanyl-5-(phosphonooxymethyl)oxolan-2-yl]oxy-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate
MOLECULAR FORMULA: C20H32N5O21P3
MOLECULAR WEIGHT: 771.410263
SMILES: C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O[C@@H]4[C@@H]([C@@H]([C@H](O4)COP(=O)(O)O)O)O[C@@H]5[C@@H]([C@@H]([C@H](O5)COP(=O)(O)O)O)O

CAS RN: 93851-05-9
CAS Name: (E,3R)-1-cyclohexyl-4,4-dimethyl-2-(1,2,4-triazol-1-yl)-1-penten-3-ol
OPENEYE Name: (E,3R)-1-cyclohexyl-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol
IUPAC Name: (E,3R)-1-cyclohexyl-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol
SYSTEMATIC NAME: (E,3R)-1-cyclohexyl-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol
MOLECULAR FORMULA: C15H25N3O
MOLECULAR WEIGHT: 263.3785
SMILES: CC(C)(C)[C@H](/C(=C\C1CCCCC1)/N2C=NC=N2)O

CAS RN: 94023-34-4
CAS Name: acetic acid; N-[2-(1-aziridinyl)-2-[[1-(1-aziridinyl)-2-(1-oxododecylamino)ethyl]amino]ethyl]dodecanamide
OPENEYE Name: acetic acid; N-[2-(aziridin-1-yl)-2-[[1-(aziridin-1-yl)-2-(dodecanoylamino)ethyl]amino]ethyl]dodecanamide
IUPAC Name: acetic acid; N-[2-(aziridin-1-yl)-2-[[1-(aziridin-1-yl)-2-(dodecanoylamino)ethyl]amino]ethyl]dodecanamide
SYSTEMATIC NAME: N-[2-(aziridin-1-yl)-2-[[1-(aziridin-1-yl)-2-(dodecanoylamino)ethyl]amino]ethyl]dodecanamide; ethanoic acid
MOLECULAR FORMULA: C34H67N5O4
MOLECULAR WEIGHT: 609.92688
SMILES: CCCCCCCCCCCC(=O)NCC(NC(CNC(=O)CCCCCCCCCCC)N1CC1)N2CC2.CC(=O)O

CAS RN: 93045-02-4
CAS Name: [2-[2-(2-ammoniophenyl)ethyl]phenyl]ammonium; phosphonato phosphate
OPENEYE Name: [2-[2-(2-azaniumylphenyl)ethyl]phenyl]ammonium; phosphonato phosphate
IUPAC Name: [2-[2-(2-azaniumylphenyl)ethyl]phenyl]azanium; phosphonato phosphate
SYSTEMATIC NAME: [2-[2-(2-azaniumylphenyl)ethyl]phenyl]azanium; phosphonato phosphate
MOLECULAR FORMULA: C28H36N4O7P2
MOLECULAR WEIGHT: 602.555562
SMILES: C1=CC=C(C(=C1)CCC2=CC=CC=C2[NH3+])[NH3+].C1=CC=C(C(=C1)CCC2=CC=CC=C2[NH3+])[NH3+].[O-]P(=O)([O-])OP(=O)([O-])[O-]

CAS RN: 78268-31-2
CAS Name: 5-[2-hydroxy-3-[4-[(E)-1-oxo-3-(3,4,5-trimethoxyphenyl)prop-2-enyl]-1-piperazinyl]propoxy]-2,3-dihydro-1,4-benzodioxin-8-carboxylic acid 3-methylbutyl ester hydrochloride
OPENEYE Name: isopentyl 5-[2-hydroxy-3-[4-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]piperazin-1-yl]propoxy]-2,3-dihydro-1,4-benzodioxine-8-carboxylate hydrochloride
IUPAC Name: 3-methylbutyl 5-[2-hydroxy-3-[4-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]piperazin-1-yl]propoxy]-2,3-dihydro-1,4-benzodioxine-8-carboxylate hydrochloride
SYSTEMATIC NAME: 3-methylbutyl 5-[2-oxidanyl-3-[4-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]piperazin-1-yl]propoxy]-2,3-dihydro-1,4-benzodioxine-8-carboxylate hydrochloride
MOLECULAR FORMULA: C33H45ClN2O10
MOLECULAR WEIGHT: 665.1708
SMILES: CC(C)CCOC(=O)C1=C2C(=C(C=C1)OCC(CN3CCN(CC3)C(=O)/C=C/C4=CC(=C(C(=C4)OC)OC)OC)O)OCCO2.Cl

CAS RN: 117743-02-9
CAS Name: sodium; 3-hydroxy-2,2-bis(hydroxymethyl)-1-heptanesulfonate; 2-methyloxirane; oxirane
OPENEYE Name: sodium; 3-hydroxy-2,2-bis(hydroxymethyl)heptane-1-sulfonate; 2-methyloxirane; oxirane
IUPAC Name: sodium; 3-hydroxy-2,2-bis(hydroxymethyl)heptane-1-sulfonate; 2-methyloxirane; oxirane
SYSTEMATIC NAME: sodium; 2,2-bis(hydroxymethyl)-3-oxidanyl-heptane-1-sulfonate; 2-methyloxirane; oxirane
MOLECULAR FORMULA: C14H29NaO8S
MOLECULAR WEIGHT: 380.43003
SMILES: CCCCC(C(CO)(CO)CS(=O)(=O)[O-])O.CC1CO1.C1CO1.[Na+]

CAS RN: 131689-26-4
CAS Name: sodium; 3-hydroxy-2,2-bis(hydroxymethyl)-1-heptanesulfonate; 2-methyloxirane; oxirane
OPENEYE Name: sodium; 3-hydroxy-2,2-bis(hydroxymethyl)heptane-1-sulfonate; 2-methyloxirane; oxirane
IUPAC Name: sodium; 3-hydroxy-2,2-bis(hydroxymethyl)heptane-1-sulfonate; 2-methyloxirane; oxirane
SYSTEMATIC NAME: sodium; 2,2-bis(hydroxymethyl)-3-oxidanyl-heptane-1-sulfonate; 2-methyloxirane; oxirane
MOLECULAR FORMULA: C14H29NaO8S
MOLECULAR WEIGHT: 380.43003
SMILES: CCCCC(C(CO)(CO)CS(=O)(=O)[O-])O.CC1CO1.C1CO1.[Na+]

CAS RN: 155490-74-7
CAS Name: sodium; 3-hydroxy-2,2-bis(hydroxymethyl)-1-heptanesulfonate; 2-methyloxirane; oxirane
OPENEYE Name: sodium; 3-hydroxy-2,2-bis(hydroxymethyl)heptane-1-sulfonate; 2-methyloxirane; oxirane
IUPAC Name: sodium; 3-hydroxy-2,2-bis(hydroxymethyl)heptane-1-sulfonate; 2-methyloxirane; oxirane
SYSTEMATIC NAME: sodium; 2,2-bis(hydroxymethyl)-3-oxidanyl-heptane-1-sulfonate; 2-methyloxirane; oxirane
MOLECULAR FORMULA: C14H29NaO8S
MOLECULAR WEIGHT: 380.43003
SMILES: CCCCC(C(CO)(CO)CS(=O)(=O)[O-])O.CC1CO1.C1CO1.[Na+]

CAS RN: 261373-90-4
CAS Name: sodium; 3-hydroxy-2,2-bis(hydroxymethyl)-1-heptanesulfonate; 2-methyloxirane; oxirane
OPENEYE Name: sodium; 3-hydroxy-2,2-bis(hydroxymethyl)heptane-1-sulfonate; 2-methyloxirane; oxirane
IUPAC Name: sodium; 3-hydroxy-2,2-bis(hydroxymethyl)heptane-1-sulfonate; 2-methyloxirane; oxirane
SYSTEMATIC NAME: sodium; 2,2-bis(hydroxymethyl)-3-oxidanyl-heptane-1-sulfonate; 2-methyloxirane; oxirane
MOLECULAR FORMULA: C14H29NaO8S
MOLECULAR WEIGHT: 380.43003
SMILES: CCCCC(C(CO)(CO)CS(=O)(=O)[O-])O.CC1CO1.C1CO1.[Na+]

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