CAS RN: 37388-41-3
CAS Name: 2-[2-[1-[(1-ethyl-2-pyrrolyl)methyl]cyclopentyl]phenyl]-2-hydroxyacetate
OPENEYE Name: 2-[2-[1-[(1-ethylpyrrol-2-yl)methyl]cyclopentyl]phenyl]-2-hydroxy-acetate
IUPAC Name: 2-[2-[1-[(1-ethylpyrrol-2-yl)methyl]cyclopentyl]phenyl]-2-hydroxyacetate
SYSTEMATIC NAME: 2-[2-[1-[(1-ethylpyrrol-2-yl)methyl]cyclopentyl]phenyl]-2-oxidanyl-ethanoate
MOLECULAR FORMULA: C20H24NO3-
MOLECULAR WEIGHT: 326.40946
SMILES: CCN1C=CC=C1CC2(CCCC2)C3=CC=CC=C3C(C(=O)[O-])O
Structure:
CAS RN: 37349-30-7
CAS Name: oxoniobium hydroxide
OPENEYE Name: oxoniobium hydroxide
IUPAC Name: oxoniobium hydroxide
SYSTEMATIC NAME: oxidanylideneniobium hydroxide
MOLECULAR FORMULA: HNbO2-
MOLECULAR WEIGHT: 125.91312
SMILES: [OH-].O=[Nb]
Structure:
CAS RN: 37220-39-6
CAS Name: bismuth oxotungsten
OPENEYE Name: bismuth oxotungsten
IUPAC Name: bismuth oxotungsten
SYSTEMATIC NAME: bismuth oxidanylidenetungsten
MOLECULAR FORMULA: BiOW+3
MOLECULAR WEIGHT: 408.81978
SMILES: O=[W].[Bi+3]
Structure:
CAS RN: 36926-31-5
CAS Name: 4,8-dichloro-2,6-bis(1-piperidinyl)pyrimido[5,4-d]pyrimidine
OPENEYE Name: 4,8-dichloro-2,6-bis(1-piperidyl)pyrimido[5,4-d]pyrimidine
IUPAC Name: 4,8-dichloro-2,6-di(piperidin-1-yl)pyrimido[5,4-d]pyrimidine
SYSTEMATIC NAME: 4,8-bis(chloranyl)-2,6-di(piperidin-1-yl)pyrimido[5,4-d]pyrimidine
MOLECULAR FORMULA: C16H20Cl2N6
MOLECULAR WEIGHT: 367.2762
SMILES: C1CCN(CC1)C2=NC3=C(C(=N2)Cl)N=C(N=C3Cl)N4CCCCC4
Structure:
CAS RN: 36748-82-0
CAS Name: 3-methyl-5-phenyl-2-pentanol
OPENEYE Name: 3-methyl-5-phenyl-pentan-2-ol
IUPAC Name: 3-methyl-5-phenylpentan-2-ol
SYSTEMATIC NAME: 3-methyl-5-phenyl-pentan-2-ol
MOLECULAR FORMULA: C12H18O
MOLECULAR WEIGHT: 178.27072
SMILES: CC(CCC1=CC=CC=C1)C(C)O
Structure:
CAS RN: 36211-44-6
CAS Name: cadmium; 3,5,5-trimethylhexanoate
OPENEYE Name: cadmium; 3,5,5-trimethylhexanoate
IUPAC Name: cadmium; 3,5,5-trimethylhexanoate
SYSTEMATIC NAME: cadmium; 3,5,5-trimethylhexanoate
MOLECULAR FORMULA: C9H17CdO2-
MOLECULAR WEIGHT: 269.64108
SMILES: CC(CC(=O)[O-])CC(C)(C)C.[Cd]
Structure:
CAS RN: 36190-62-2
CAS Name: zinc N,N-bis(2-methylpropyl)carbamothioate carbamothioate
OPENEYE Name: zinc N,N-diisobutylcarbamothioate carbamothioate
IUPAC Name: zinc N,N-bis(2-methylpropyl)carbamothioate carbamothioate
SYSTEMATIC NAME: zinc N,N-bis(2-methylpropyl)carbamothioate carbamothioate
MOLECULAR FORMULA: C10H20N2O2S2Zn
MOLECULAR WEIGHT: 329.817
SMILES: CC(C)CN(CC(C)C)C(=S)[O-].C(=S)(N)[O-].[Zn+2]
Structure:
CAS RN: 72134-86-2
CAS Name: zinc N,N-bis(2-methylpropyl)carbamothioate carbamothioate
OPENEYE Name: zinc N,N-diisobutylcarbamothioate carbamothioate
IUPAC Name: zinc N,N-bis(2-methylpropyl)carbamothioate carbamothioate
SYSTEMATIC NAME: zinc N,N-bis(2-methylpropyl)carbamothioate carbamothioate
MOLECULAR FORMULA: C10H20N2O2S2Zn
MOLECULAR WEIGHT: 329.817
SMILES: CC(C)CN(CC(C)C)C(=S)[O-].C(=S)(N)[O-].[Zn+2]
Structure:
CAS RN: 34279-38-4
CAS Name: 2-[8,13-diethyl-18-methoxycarbonyl-20-(2-methoxy-2-oxoethyl)-2,3,7,12,17-pentamethyl-22,23-dihydro-3H-porphyrin-2-yl]propanoate
OPENEYE Name: 2-[8,13-diethyl-18-methoxycarbonyl-20-(2-methoxy-2-oxo-ethyl)-2,3,7,12,17-pentamethyl-22,23-dihydro-3H-porphyrin-2-yl]propanoate
IUPAC Name: 2-[8,13-diethyl-18-methoxycarbonyl-20-(2-methoxy-2-oxoethyl)-2,3,7,12,17-pentamethyl-22,23-dihydro-3H-porphyrin-2-yl]propanoate
SYSTEMATIC NAME: 2-[8,13-diethyl-18-methoxycarbonyl-20-(2-methoxy-2-oxidanylidene-ethyl)-2,3,7,12,17-pentamethyl-22,23-dihydro-3H-porphyrin-2-yl]propanoate
MOLECULAR FORMULA: C37H43N4O6-
MOLECULAR WEIGHT: 639.76052
SMILES: CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(C(C(=N4)C(=C5C(=C(C(=N5)C=C1N2)C)C(=O)OC)CC(=O)OC)(C)C(C)C(=O)[O-])C)C)CC)C
Structure:
CAS RN: 33889-26-8
CAS Name: (Z)-9-octadecenoic acid (4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) ester
OPENEYE Name: (1,7,7-trimethylnorbornan-2-yl) (Z)-octadec-9-enoate
IUPAC Name: (4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) (Z)-octadec-9-enoate
SYSTEMATIC NAME: (4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) (Z)-octadec-9-enoate
MOLECULAR FORMULA: C28H50O2
MOLECULAR WEIGHT: 418.6954
SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)OC1CC2CCC1(C2(C)C)C
Structure:
CAS RN: 33869-97-5
CAS Name: 3,5-dichloro-4-[4-(3-cyanopropylamino)phenyl]azo-N-[2-(1-pyridin-1-iumyl)ethyl]benzenesulfonamide chloride
OPENEYE Name: 3,5-dichloro-4-[4-(3-cyanopropylamino)phenyl]azo-N-(2-pyridin-1-ium-1-ylethyl)benzenesulfonamide chloride
IUPAC Name: 3,5-dichloro-4-[[4-(3-cyanopropylamino)phenyl]diazenyl]-N-(2-pyridin-1-ium-1-ylethyl)benzenesulfonamide chloride
SYSTEMATIC NAME: 3,5-bis(chloranyl)-4-[[4-(3-cyanopropylamino)phenyl]diazenyl]-N-(2-pyridin-1-ium-1-ylethyl)benzenesulfonamide chloride
MOLECULAR FORMULA: C23H23Cl3N6O2S
MOLECULAR WEIGHT: 553.89172
SMILES: C1=CC=[N+](C=C1)CCNS(=O)(=O)C2=CC(=C(C(=C2)Cl)N=NC3=CC=C(C=C3)NCCCC#N)Cl.[Cl-]
Structure:
CAS RN: 33386-23-1
CAS Name: 5-chloro-1,3-dihydroimidazo[4,5-b]pyrazin-2-one
OPENEYE Name: 5-chloro-1,3-dihydroimidazo[4,5-b]pyrazin-2-one
IUPAC Name: 5-chloro-1,3-dihydroimidazo[4,5-b]pyrazin-2-one
SYSTEMATIC NAME: 5-chloranyl-1,3-dihydroimidazo[4,5-b]pyrazin-2-one
MOLECULAR FORMULA: C5H3ClN4O
MOLECULAR WEIGHT: 170.55652
SMILES: C1=C(N=C2C(=N1)NC(=O)N2)Cl
Structure:
CAS RN: 33124-27-5
CAS Name: acetic acid [3-(dimethylamino)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] ester; iodomethane
OPENEYE Name: [2-(dimethylamino)-1,7,7-trimethyl-norbornan-2-yl] acetate; iodomethane
IUPAC Name: [3-(dimethylamino)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] acetate; iodomethane
SYSTEMATIC NAME: [3-(dimethylamino)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] ethanoate; iodanylmethane
MOLECULAR FORMULA: C15H28INO2
MOLECULAR WEIGHT: 381.29279
SMILES: CC(=O)OC1(CC2CCC1(C2(C)C)C)N(C)C.CI
Structure:
CAS RN: 30583-08-5
CAS Name: (7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)methanesulfonate; piperazine
OPENEYE Name: (7,7-dimethyl-2-oxo-norbornan-1-yl)methanesulfonate; piperazine
IUPAC Name: (7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)methanesulfonate; piperazine
SYSTEMATIC NAME: (7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl)methanesulfonate; piperazine
MOLECULAR FORMULA: C14H25N2O4S-
MOLECULAR WEIGHT: 317.4243
SMILES: CC1(C2CCC1(C(=O)C2)CS(=O)(=O)[O-])C.C1CNCCN1
Structure:
CAS RN: 29870-20-0
CAS Name: bis(2-hydroxyethyl)ammonium; 2,3,4-trihydroxy-4-oxobutanoate
OPENEYE Name: bis(2-hydroxyethyl)ammonium; 2,3,4-trihydroxy-4-oxo-butanoate
IUPAC Name: bis(2-hydroxyethyl)azanium; 2,3,4-trihydroxy-4-oxobutanoate
SYSTEMATIC NAME: bis(2-hydroxyethyl)azanium; 2,3,4-tris(oxidanyl)-4-oxidanylidene-butanoate
MOLECULAR FORMULA: C8H17NO8
MOLECULAR WEIGHT: 255.22248
SMILES: C(CO)[NH2+]CCO.C(C(C(=O)[O-])O)(C(=O)O)O
Structure:
CAS RN: 29853-65-4
CAS Name: aluminum tellurite
OPENEYE Name: aluminum tellurite
IUPAC Name: aluminum tellurite
SYSTEMATIC NAME: aluminum tellurite
MOLECULAR FORMULA: AlO3Te+
MOLECULAR WEIGHT: 202.579738
SMILES: [O-][Te](=O)[O-].[Al+3]
Structure:
CAS RN: 58500-12-2
CAS Name: aluminum tellurite
OPENEYE Name: aluminum tellurite
IUPAC Name: aluminum tellurite
SYSTEMATIC NAME: aluminum tellurite
MOLECULAR FORMULA: AlO3Te+
MOLECULAR WEIGHT: 202.579738
SMILES: [O-][Te](=O)[O-].[Al+3]
Structure:
CAS RN: 29120-27-2
CAS Name: 4-[(1,4-dimethyl-1,5-dihydro-1,2,4-triazol-1-ium-3-yl)azo]-N,N-diethylaniline chloride
OPENEYE Name: 4-[(1,4-dimethyl-1,5-dihydro-1,2,4-triazol-1-ium-3-yl)azo]-N,N-diethyl-aniline chloride
IUPAC Name: 4-[(1,4-dimethyl-1,5-dihydro-1,2,4-triazol-1-ium-3-yl)diazenyl]-N,N-diethylaniline chloride
SYSTEMATIC NAME: 4-[(1,4-dimethyl-1,5-dihydro-1,2,4-triazol-1-ium-3-yl)diazenyl]-N,N-diethyl-aniline chloride
MOLECULAR FORMULA: C14H23ClN6
MOLECULAR WEIGHT: 310.82562
SMILES: CCN(CC)C1=CC=C(C=C1)N=NC2=N[NH+](CN2C)C.[Cl-]
Structure:
CAS RN: 28622-64-2
CAS Name: 7-(hydroxymethyl)-12-methyl-10,11-dihydrobenzo[a]anthracene-10,11-diol
OPENEYE Name: 7-(hydroxymethyl)-12-methyl-10,11-dihydrobenzo[a]anthracene-10,11-diol
IUPAC Name: 7-(hydroxymethyl)-12-methyl-10,11-dihydrobenzo[a]anthracene-10,11-diol
SYSTEMATIC NAME: 7-(hydroxymethyl)-12-methyl-10,11-dihydrobenzo[a]anthracene-10,11-diol
MOLECULAR FORMULA: C20H18O3
MOLECULAR WEIGHT: 306.35512
SMILES: CC1=C2C(C(C=CC2=C(C3=C1C4=CC=CC=C4C=C3)CO)O)O
Structure:
CAS RN: 27388-88-1
CAS Name: californium-252 chloride
OPENEYE Name: californium-252 chloride
IUPAC Name: californium-252 chloride
SYSTEMATIC NAME: californium-252 chloride
MOLECULAR FORMULA: CfCl-
MOLECULAR WEIGHT: 287.53462
SMILES: [Cl-].[252Cf]
Structure:
CAS RN: 27287-73-6
CAS Name: 2-amino-6-methyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one
OPENEYE Name: 2-amino-6-methyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one
IUPAC Name: 2-amino-6-methyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one
SYSTEMATIC NAME: 2-azanyl-6-methyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one
MOLECULAR FORMULA: C6H7N5O
MOLECULAR WEIGHT: 165.15268
SMILES: CC1=CN2C(=NC1=O)N=C(N2)N
Structure:
CAS RN: 26719-07-3
CAS Name: 2-chloroacetate; mercury(2+)
OPENEYE Name: mercuric 2-chloroacetate
IUPAC Name: 2-chloroacetate; mercury(2+)
SYSTEMATIC NAME: 2-chloranylethanoate; mercury(2+)
MOLECULAR FORMULA: C2H2ClHgO2+
MOLECULAR WEIGHT: 294.07908
SMILES: C(C(=O)[O-])Cl.[Hg+2]
Structure:
CAS RN: 26655-71-0
CAS Name: 1,2,3,4,4a,5,6,7-octahydroanthracene
OPENEYE Name: 1,2,3,4,4a,5,6,7-octahydroanthracene
IUPAC Name: 1,2,3,4,4a,5,6,7-octahydroanthracene
SYSTEMATIC NAME: 1,2,3,4,4a,5,6,7-octahydroanthracene
MOLECULAR FORMULA: C14H18
MOLECULAR WEIGHT: 186.29272
SMILES: C1CCC2=CC3=CCCCC3=CC2C1
Structure:
CAS RN: 26640-04-0
CAS Name: 18-(1-carboxyethyl)-8,12-diethyl-3,7,13,17-tetramethyl-21,24-dihydroporphyrin-2-carboxylic acid
OPENEYE Name: 18-(1-carboxyethyl)-8,12-diethyl-3,7,13,17-tetramethyl-21,24-dihydroporphyrin-2-carboxylic acid
IUPAC Name: 18-(1-carboxyethyl)-8,12-diethyl-3,7,13,17-tetramethyl-21,24-dihydroporphyrin-2-carboxylic acid
SYSTEMATIC NAME: 8,12-diethyl-3,7,13,17-tetramethyl-18-(1-oxidanyl-1-oxidanylidene-propan-2-yl)-21,24-dihydroporphyrin-2-carboxylic acid
MOLECULAR FORMULA: C32H34N4O4
MOLECULAR WEIGHT: 538.63676
SMILES: CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=CC5=NC(=CC1=N2)C(=C5C)CC)N4)C)C(=O)O)C(C)C(=O)O)C)C
Structure:
CAS RN: 26494-77-9
CAS Name: 3-methyl-1,1-dioxo-1,4-thiazinan-4-amine
OPENEYE Name: 3-methyl-1,1-dioxo-1,4-thiazinan-4-amine
IUPAC Name: 3-methyl-1,1-dioxo-1,4-thiazinan-4-amine
SYSTEMATIC NAME: 3-methyl-1,1-bis(oxidanylidene)-1,4-thiazinan-4-amine
MOLECULAR FORMULA: C5H12N2O2S
MOLECULAR WEIGHT: 164.22598
SMILES: CC1CS(=O)(=O)CCN1N
Structure:
CAS RN: 26416-07-9
CAS Name: chromium(3+); 2-methyl-2-propenoate
OPENEYE Name: chromic 2-methylprop-2-enoate
IUPAC Name: chromium(3+); 2-methylprop-2-enoate
SYSTEMATIC NAME: chromium(3+); 2-methylprop-2-enoate
MOLECULAR FORMULA: C4H5CrO2+2
MOLECULAR WEIGHT: 137.0774
SMILES: CC(=C)C(=O)[O-].[Cr+3]
Structure:
CAS RN: 26271-85-2
CAS Name: rubidium selenite
OPENEYE Name: rubidium selenite
IUPAC Name: rubidium selenite
SYSTEMATIC NAME: rubidium selenite
MOLECULAR FORMULA: O3RbSe-2
MOLECULAR WEIGHT: 212.426
SMILES: [O-][Se](=O)[O-].[Rb]
Structure:
CAS RN: 26248-98-6
CAS Name: 4,6-dichloro-1,6a-dihydroimidazo[4,5-d]imidazole-2,5-dione
OPENEYE Name: 4,6-dichloro-1,6a-dihydroimidazo[4,5-d]imidazole-2,5-dione
IUPAC Name: 4,6-dichloro-1,6a-dihydroimidazo[4,5-d]imidazole-2,5-dione
SYSTEMATIC NAME: 4,6-bis(chloranyl)-1,6a-dihydroimidazo[4,5-d]imidazole-2,5-dione
MOLECULAR FORMULA: C4H2Cl2N4O2
MOLECULAR WEIGHT: 208.99028
SMILES: C12C(=NC(=O)N1)N(C(=O)N2Cl)Cl
Structure:
CAS RN: 25729-41-3
CAS Name: argon-39
OPENEYE Name: argon-39
IUPAC Name: argon-39
SYSTEMATIC NAME: argon-39
MOLECULAR FORMULA: Ar
MOLECULAR WEIGHT: 38.964313
SMILES: [39Ar]
Structure:
CAS RN: 25418-96-6
CAS Name: decanedioate; neodymium(3+)
OPENEYE Name: decanedioate; neodymium(3+)
IUPAC Name: decanedioate; neodymium(3+)
SYSTEMATIC NAME: decanedioate; neodymium(3+)
MOLECULAR FORMULA: C10H16NdO4+
MOLECULAR WEIGHT: 344.47164
SMILES: C(CCCCC(=O)[O-])CCCC(=O)[O-].[Nd+3]
Structure:
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