CAS RN: 352303-67-4
CAS Name: (2-fluoro-3-methoxyphenyl)boronic acid
OPENEYE Name: (2-fluoro-3-methoxy-phenyl)boronic acid
IUPAC Name: (2-fluoro-3-methoxyphenyl)boronic acid
SYSTEMATIC NAME: (2-fluoranyl-3-methoxy-phenyl)boronic acid
MOLECULAR FORMULA: C7H8BFO3
MOLECULAR WEIGHT: 169.946023
SMILES: B(C1=C(C(=CC=C1)OC)F)(O)O
Structure:
CAS RN: 4075-44-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C43H59N3O12
MOLECULAR WEIGHT: 809.94146
SMILES: CC1C=CC=C(C(=O)NC2=C(C3=C(C4=C(C(=C3O)C)OC(C4=O)(OC=CC(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C(=C2CN5CCN(CC5)C)O)O)C
Structure:
CAS RN: 121-88-0
CAS Name: 2-amino-5-nitrophenol
OPENEYE Name: 2-amino-5-nitro-phenol
IUPAC Name: 2-amino-5-nitrophenol
SYSTEMATIC NAME: 2-azanyl-5-nitro-phenol
MOLECULAR FORMULA: C6H6N2O3
MOLECULAR WEIGHT: 154.12344
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])O)N
Structure:
CAS RN: 667437-43-6
CAS Name: 3-[(4-fluorophenoxy)methyl]-4-methyl-1H-1,2,4-triazole-5-thione
OPENEYE Name: 3-[(4-fluorophenoxy)methyl]-4-methyl-1H-1,2,4-triazole-5-thione
IUPAC Name: 3-[(4-fluorophenoxy)methyl]-4-methyl-1H-1,2,4-triazole-5-thione
SYSTEMATIC NAME: 3-[(4-fluoranylphenoxy)methyl]-4-methyl-1H-1,2,4-triazole-5-thione
MOLECULAR FORMULA: C10H10FN3OS
MOLECULAR WEIGHT: 239.269303
SMILES: CN1C(=NNC1=S)COC2=CC=C(C=C2)F
Structure:
CAS RN: 62476-58-8
CAS Name: 2-chloro-3-(trifluoromethyl)aniline
OPENEYE Name: 2-chloro-3-(trifluoromethyl)aniline
IUPAC Name: 2-chloro-3-(trifluoromethyl)aniline
SYSTEMATIC NAME: 2-chloranyl-3-(trifluoromethyl)aniline
MOLECULAR FORMULA: C7H5ClF3N
MOLECULAR WEIGHT: 195.56951
SMILES: C1=CC(=C(C(=C1)N)Cl)C(F)(F)F
Structure:
CAS RN: 952-10-3
CAS Name: 2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonyl chloride
OPENEYE Name: 2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonyl chloride
IUPAC Name: 2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonyl chloride
SYSTEMATIC NAME: 2,3-bis(oxidanylidene)-1,4-dihydroquinoxaline-6-sulfonyl chloride
MOLECULAR FORMULA: C8H5ClN2O4S
MOLECULAR WEIGHT: 260.6543
SMILES: C1=CC2=C(C=C1S(=O)(=O)Cl)NC(=O)C(=O)N2
Structure:
CAS RN: 13949-50-3
CAS Name: 6-chloro-2-(chloromethyl)-4-(2-chlorophenyl)-3-oxidoquinazolin-3-ium
OPENEYE Name: 6-chloro-2-(chloromethyl)-4-(2-chlorophenyl)-3-oxido-quinazolin-3-ium
IUPAC Name: 6-chloro-2-(chloromethyl)-4-(2-chlorophenyl)-3-oxidoquinazolin-3-ium
SYSTEMATIC NAME: 6-chloranyl-2-(chloromethyl)-4-(2-chlorophenyl)-3-oxidanidyl-quinazolin-3-ium
MOLECULAR FORMULA: C15H9Cl3N2O
MOLECULAR WEIGHT: 339.60376
SMILES: C1=CC=C(C(=C1)C2=[N+](C(=NC3=C2C=C(C=C3)Cl)CCl)[O-])Cl
Structure:
CAS RN: 4792-71-6
CAS Name: 5,7-dichloro-1H-indole-2-carboxylic acid
OPENEYE Name: 5,7-dichloro-1H-indole-2-carboxylic acid
IUPAC Name: 5,7-dichloro-1H-indole-2-carboxylic acid
SYSTEMATIC NAME: 5,7-bis(chloranyl)-1H-indole-2-carboxylic acid
MOLECULAR FORMULA: C9H5Cl2NO2
MOLECULAR WEIGHT: 230.0475
SMILES: C1=C2C=C(NC2=C(C=C1Cl)Cl)C(=O)O
Structure:
CAS RN: 71555-34-5
CAS Name: 4-phenyl-N-[1-(2-pyridinyl)ethylideneamino]-1-piperidinecarbothioamide
OPENEYE Name: 4-phenyl-N-[1-(2-pyridyl)ethylideneamino]piperidine-1-carbothioamide
IUPAC Name: 4-phenyl-N-(1-pyridin-2-ylethylideneamino)piperidine-1-carbothioamide
SYSTEMATIC NAME: 4-phenyl-N-(1-pyridin-2-ylethylideneamino)piperidine-1-carbothioamide
MOLECULAR FORMULA: C19H22N4S
MOLECULAR WEIGHT: 338.46978
SMILES: CC(=NNC(=S)N1CCC(CC1)C2=CC=CC=C2)C3=CC=CC=N3
Structure:
CAS RN: 77747-78-5
CAS Name: 4-(2-hydroxyethylamino)-2,2-dimethyl-1,3-dihydropyridine-6-thione
OPENEYE Name: 4-(2-hydroxyethylamino)-2,2-dimethyl-1,3-dihydropyridine-6-thione
IUPAC Name: 4-(2-hydroxyethylamino)-2,2-dimethyl-1,3-dihydropyridine-6-thione
SYSTEMATIC NAME: 4-(2-hydroxyethylamino)-2,2-dimethyl-1,3-dihydropyridine-6-thione
MOLECULAR FORMULA: C9H16N2OS
MOLECULAR WEIGHT: 200.30114
SMILES: CC1(CC(=CC(=S)N1)NCCO)C
Structure:
CAS RN: 84458-52-6
CAS Name: 7-nitro-4-(7H-purin-6-ylthio)-2,1,3-benzoxadiazole
OPENEYE Name: 7-nitro-4-(7H-purin-6-ylsulfanyl)-2,1,3-benzoxadiazole
IUPAC Name: 7-nitro-4-(7H-purin-6-ylsulfanyl)-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 7-nitro-4-(7H-purin-6-ylsulfanyl)-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C11H5N7O3S
MOLECULAR WEIGHT: 315.2675
SMILES: C1=C(C2=NON=C2C(=C1)SC3=NC=NC4=C3NC=N4)[N+](=O)[O-]
Structure:
CAS RN: 573997-99-6
CAS Name: 3-chloro-N-(3-ethylphenyl)propanamide
OPENEYE Name: 3-chloro-N-(3-ethylphenyl)propanamide
IUPAC Name: 3-chloro-N-(3-ethylphenyl)propanamide
SYSTEMATIC NAME: 3-chloranyl-N-(3-ethylphenyl)propanamide
MOLECULAR FORMULA: C11H14ClNO
MOLECULAR WEIGHT: 211.68796
SMILES: CCC1=CC(=CC=C1)NC(=O)CCCl
Structure:
CAS RN: 208186-84-9
CAS Name: (2-chloro-4-fluorophenyl)methanol
OPENEYE Name: (2-chloro-4-fluoro-phenyl)methanol
IUPAC Name: (2-chloro-4-fluorophenyl)methanol
SYSTEMATIC NAME: (2-chloranyl-4-fluoranyl-phenyl)methanol
MOLECULAR FORMULA: C7H6ClFO
MOLECULAR WEIGHT: 160.573343
SMILES: C1=CC(=C(C=C1F)Cl)CO
Structure:
CAS RN: 85687-01-0
CAS Name: 2-(6,7-dimethyl-1-phenyl-3-pyrazolo[4,3-b]quinoxalinyl)oxolane-3,4-diol
OPENEYE Name: 2-(6,7-dimethyl-1-phenyl-pyrazolo[4,3-b]quinoxalin-3-yl)tetrahydrofuran-3,4-diol
IUPAC Name: 2-(6,7-dimethyl-1-phenylpyrazolo[4,3-b]quinoxalin-3-yl)oxolane-3,4-diol
SYSTEMATIC NAME: 2-(6,7-dimethyl-1-phenyl-pyrazolo[4,3-b]quinoxalin-3-yl)oxolane-3,4-diol
MOLECULAR FORMULA: C21H20N4O3
MOLECULAR WEIGHT: 376.4085
SMILES: CC1=CC2=C(C=C1C)N=C3C(=N2)C(=NN3C4=CC=CC=C4)C5C(C(CO5)O)O
Structure:
CAS RN: 5602-72-2
CAS Name: 2,4-dichloro-N-hydroxy-N'-(4-methylphenyl)benzenecarboximidamide
OPENEYE Name: 2,4-dichloro-N-hydroxy-N'-(p-tolyl)benzamidine
IUPAC Name: 2,4-dichloro-N-hydroxy-N'-(4-methylphenyl)benzenecarboximidamide
SYSTEMATIC NAME: 2,4-bis(chloranyl)-N'-(4-methylphenyl)-N-oxidanyl-benzenecarboximidamide
MOLECULAR FORMULA: C14H12Cl2N2O
MOLECULAR WEIGHT: 295.16388
SMILES: CC1=CC=C(C=C1)N=C(C2=C(C=C(C=C2)Cl)Cl)NO
Structure:
CAS RN: 879636-95-0
CAS Name: 2-(3-methoxyphenyl)-4-methyl-5-thiazolecarboxylic acid
OPENEYE Name: 2-(3-methoxyphenyl)-4-methyl-thiazole-5-carboxylic acid
IUPAC Name: 2-(3-methoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
SYSTEMATIC NAME: 2-(3-methoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
MOLECULAR FORMULA: C12H11NO3S
MOLECULAR WEIGHT: 249.28564
SMILES: CC1=C(SC(=N1)C2=CC(=CC=C2)OC)C(=O)O
Structure:
CAS RN: 472805-74-6
CAS Name: 2-(2-methoxyphenyl)-4-methyl-5-thiazolecarboxylic acid
OPENEYE Name: 2-(2-methoxyphenyl)-4-methyl-thiazole-5-carboxylic acid
IUPAC Name: 2-(2-methoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
SYSTEMATIC NAME: 2-(2-methoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
MOLECULAR FORMULA: C12H11NO3S
MOLECULAR WEIGHT: 249.28564
SMILES: CC1=C(SC(=N1)C2=CC=CC=C2OC)C(=O)O
Structure:
CAS RN: 879070-37-8
CAS Name: 2-(2-fluorophenyl)-4-methyl-5-thiazolecarboxylic acid
OPENEYE Name: 2-(2-fluorophenyl)-4-methyl-thiazole-5-carboxylic acid
IUPAC Name: 2-(2-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
SYSTEMATIC NAME: 2-(2-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
MOLECULAR FORMULA: C11H8FNO2S
MOLECULAR WEIGHT: 237.250123
SMILES: CC1=C(SC(=N1)C2=CC=CC=C2F)C(=O)O
Structure:
CAS RN: 5270-08-6
CAS Name: 5-(2,4-dimethoxyphenyl)-4-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-1-(3-pyridinylmethyl)pyrrolidine-2,3-dione
OPENEYE Name: 5-(2,4-dimethoxyphenyl)-4-[hydroxy-(4-isopropoxyphenyl)methylene]-1-(3-pyridylmethyl)pyrrolidine-2,3-dione
IUPAC Name: 5-(2,4-dimethoxyphenyl)-4-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
SYSTEMATIC NAME: 5-(2,4-dimethoxyphenyl)-4-[oxidanyl-(4-propan-2-yloxyphenyl)methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
MOLECULAR FORMULA: C28H28N2O6
MOLECULAR WEIGHT: 488.53172
SMILES: CC(C)OC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC3=CN=CC=C3)C4=C(C=C(C=C4)OC)OC)O
Structure:
CAS RN: 5267-82-3
CAS Name: 7-(2-hydroxyethyl)-8-[2-[(4-methoxyphenyl)methylidene]hydrazinyl]-3-methylpurine-2,6-dione
OPENEYE Name: 7-(2-hydroxyethyl)-8-[2-[(4-methoxyphenyl)methylene]hydrazino]-3-methyl-purine-2,6-dione
IUPAC Name: 7-(2-hydroxyethyl)-8-[2-[(4-methoxyphenyl)methylidene]hydrazinyl]-3-methylpurine-2,6-dione
SYSTEMATIC NAME: 7-(2-hydroxyethyl)-8-[2-[(4-methoxyphenyl)methylidene]hydrazinyl]-3-methyl-purine-2,6-dione
MOLECULAR FORMULA: C16H18N6O4
MOLECULAR WEIGHT: 358.35192
SMILES: CN1C2=C(C(=O)NC1=O)N(C(=N2)NN=CC3=CC=C(C=C3)OC)CCO
Structure:
CAS RN: 53983-15-6
CAS Name: 5-amino-4-phenyl-3-isoxazolecarboxylic acid ethyl ester
OPENEYE Name: ethyl 5-amino-4-phenyl-isoxazole-3-carboxylate
IUPAC Name: ethyl 5-amino-4-phenyl-1,2-oxazole-3-carboxylate
SYSTEMATIC NAME: ethyl 5-azanyl-4-phenyl-1,2-oxazole-3-carboxylate
MOLECULAR FORMULA: C12H12N2O3
MOLECULAR WEIGHT: 232.23528
SMILES: CCOC(=O)C1=NOC(=C1C2=CC=CC=C2)N
Structure:
CAS RN: 42780-50-7
CAS Name: 2-[2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolyl]acetonitrile
OPENEYE Name: 2-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]acetonitrile
IUPAC Name: 2-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]acetonitrile
SYSTEMATIC NAME: 2-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]ethanenitrile
MOLECULAR FORMULA: C15H16N2
MOLECULAR WEIGHT: 224.30094
SMILES: CC1=CC=C(C=C1)N2C(=CC(=C2C)CC#N)C
Structure:
CAS RN: 42780-46-1
CAS Name: 2-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]acetonitrile
OPENEYE Name: 2-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]acetonitrile
IUPAC Name: 2-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]acetonitrile
SYSTEMATIC NAME: 2-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanenitrile
MOLECULAR FORMULA: C15H16N2O
MOLECULAR WEIGHT: 240.30034
SMILES: CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)CC#N
Structure:
CAS RN: 61690-08-2
CAS Name: 4-methyl-2-[(1-methyl-2-benzimidazolyl)methyl]thiazole
OPENEYE Name: 4-methyl-2-[(1-methylbenzimidazol-2-yl)methyl]thiazole
IUPAC Name: 4-methyl-2-[(1-methylbenzimidazol-2-yl)methyl]-1,3-thiazole
SYSTEMATIC NAME: 4-methyl-2-[(1-methylbenzimidazol-2-yl)methyl]-1,3-thiazole
MOLECULAR FORMULA: C13H13N3S
MOLECULAR WEIGHT: 243.32742
SMILES: CC1=CSC(=N1)CC2=NC3=CC=CC=C3N2C
Structure:
CAS RN: 2986-60-9
CAS Name: 3-(cyclopropylmethoxy)-1-propanamine
OPENEYE Name: 3-(cyclopropylmethoxy)propan-1-amine
IUPAC Name: 3-(cyclopropylmethoxy)propan-1-amine
SYSTEMATIC NAME: 3-(cyclopropylmethoxy)propan-1-amine
MOLECULAR FORMULA: C7H15NO
MOLECULAR WEIGHT: 129.2001
SMILES: C1CC1COCCCN
Structure:
CAS RN: 10185-46-3
CAS Name: 3,4-dihydro-2H-1-benzopyran-3-ylmethanamine
OPENEYE Name: chroman-3-ylmethanamine
IUPAC Name: 3,4-dihydro-2H-chromen-3-ylmethanamine
SYSTEMATIC NAME: 3,4-dihydro-2H-chromen-3-ylmethanamine
MOLECULAR FORMULA: C10H13NO
MOLECULAR WEIGHT: 163.21632
SMILES: C1C(COC2=CC=CC=C21)CN
Structure:
CAS RN: 54001-16-0
CAS Name: 2-(4-methoxyphenyl)-4-methyl-5-thiazolecarboxylic acid
OPENEYE Name: 2-(4-methoxyphenyl)-4-methyl-thiazole-5-carboxylic acid
IUPAC Name: 2-(4-methoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
SYSTEMATIC NAME: 2-(4-methoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
MOLECULAR FORMULA: C12H11NO3S
MOLECULAR WEIGHT: 249.28564
SMILES: CC1=C(SC(=N1)C2=CC=C(C=C2)OC)C(=O)O
Structure:
CAS RN: 448229-66-1
CAS Name: 2-(4-methyl-2-thiazolyl)acetohydrazide
OPENEYE Name: 2-(4-methylthiazol-2-yl)acetohydrazide
IUPAC Name: 2-(4-methyl-1,3-thiazol-2-yl)acetohydrazide
SYSTEMATIC NAME: 2-(4-methyl-1,3-thiazol-2-yl)ethanehydrazide
MOLECULAR FORMULA: C6H9N3OS
MOLECULAR WEIGHT: 171.22016
SMILES: CC1=CSC(=N1)CC(=O)NN
Structure:
CAS RN: 91066-23-8
CAS Name: 5-(3-chloropropyl)-3-phenyl-1,2,4-oxadiazole
OPENEYE Name: 5-(3-chloropropyl)-3-phenyl-1,2,4-oxadiazole
IUPAC Name: 5-(3-chloropropyl)-3-phenyl-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-(3-chloranylpropyl)-3-phenyl-1,2,4-oxadiazole
MOLECULAR FORMULA: C11H11ClN2O
MOLECULAR WEIGHT: 222.67084
SMILES: C1=CC=C(C=C1)C2=NOC(=N2)CCCCl
Structure:
CAS RN: 125174-28-9
CAS Name: 4-(2-bromoethoxy)benzenesulfonamide
OPENEYE Name: 4-(2-bromoethoxy)benzenesulfonamide
IUPAC Name: 4-(2-bromoethoxy)benzenesulfonamide
SYSTEMATIC NAME: 4-(2-bromoethyloxy)benzenesulfonamide
MOLECULAR FORMULA: C8H10BrNO3S
MOLECULAR WEIGHT: 280.1389
SMILES: C1=CC(=CC=C1OCCBr)S(=O)(=O)N
Structure:
CAS RN: 77509-88-7
CAS Name: 5-chloro-4-(chloromethyl)-3-methyl-1-phenylpyrazole
OPENEYE Name: 5-chloro-4-(chloromethyl)-3-methyl-1-phenyl-pyrazole
IUPAC Name: 5-chloro-4-(chloromethyl)-3-methyl-1-phenylpyrazole
SYSTEMATIC NAME: 5-chloranyl-4-(chloromethyl)-3-methyl-1-phenyl-pyrazole
MOLECULAR FORMULA: C11H10Cl2N2
MOLECULAR WEIGHT: 241.1165
SMILES: CC1=NN(C(=C1CCl)Cl)C2=CC=CC=C2
Structure:
CAS RN: 42780-48-3
CAS Name: 2-[1-(4-chlorophenyl)-2,5-dimethyl-3-pyrrolyl]acetonitrile
OPENEYE Name: 2-[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]acetonitrile
IUPAC Name: 2-[1-(4-chlorophenyl)-2,5-dimethylpyrrol-3-yl]acetonitrile
SYSTEMATIC NAME: 2-[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]ethanenitrile
MOLECULAR FORMULA: C14H13ClN2
MOLECULAR WEIGHT: 244.71942
SMILES: CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)CC#N
Structure:
CAS RN: 35276-83-6
CAS Name: 3-(2-methoxyphenyl)-3-oxopropanenitrile
OPENEYE Name: 3-(2-methoxyphenyl)-3-oxo-propanenitrile
IUPAC Name: 3-(2-methoxyphenyl)-3-oxopropanenitrile
SYSTEMATIC NAME: 3-(2-methoxyphenyl)-3-oxidanylidene-propanenitrile
MOLECULAR FORMULA: C10H9NO2
MOLECULAR WEIGHT: 175.18396
SMILES: COC1=CC=CC=C1C(=O)CC#N
Structure:
CAS RN: 31915-26-1
CAS Name: 3-(2-fluorophenyl)-3-oxopropanenitrile
OPENEYE Name: 3-(2-fluorophenyl)-3-oxo-propanenitrile
IUPAC Name: 3-(2-fluorophenyl)-3-oxopropanenitrile
SYSTEMATIC NAME: 3-(2-fluorophenyl)-3-oxidanylidene-propanenitrile
MOLECULAR FORMULA: C9H6FNO
MOLECULAR WEIGHT: 163.148443
SMILES: C1=CC=C(C(=C1)C(=O)CC#N)F
Structure:
CAS RN: 77778-66-6
CAS Name: 2-fluoro-3,3,3-trimethoxypropanoic acid methyl ester
OPENEYE Name: methyl 2-fluoro-3,3,3-trimethoxy-propanoate
IUPAC Name: methyl 2-fluoro-3,3,3-trimethoxypropanoate
SYSTEMATIC NAME: methyl 2-fluoranyl-3,3,3-trimethoxy-propanoate
MOLECULAR FORMULA: C7H13FO5
MOLECULAR WEIGHT: 196.173523
SMILES: COC(=O)C(C(OC)(OC)OC)F
Structure:
CAS RN: 104296-87-9
CAS Name: 3,4-diethoxybenzenesulfonamide
OPENEYE Name: 3,4-diethoxybenzenesulfonamide
IUPAC Name: 3,4-diethoxybenzenesulfonamide
SYSTEMATIC NAME: 3,4-diethoxybenzenesulfonamide
MOLECULAR FORMULA: C10H15NO4S
MOLECULAR WEIGHT: 245.2954
SMILES: CCOC1=C(C=C(C=C1)S(=O)(=O)N)OCC
Structure:
CAS RN: 3245-53-2
CAS Name: 1-(3-bromopropoxy)-3,5-dimethylbenzene
OPENEYE Name: 1-(3-bromopropoxy)-3,5-dimethyl-benzene
IUPAC Name: 1-(3-bromopropoxy)-3,5-dimethylbenzene
SYSTEMATIC NAME: 1-(3-bromanylpropoxy)-3,5-dimethyl-benzene
MOLECULAR FORMULA: C11H15BrO
MOLECULAR WEIGHT: 243.1402
SMILES: CC1=CC(=CC(=C1)OCCCBr)C
Structure:
CAS RN: 3245-55-4
CAS Name: 2-(3-bromopropoxy)-1,4-dimethylbenzene
OPENEYE Name: 2-(3-bromopropoxy)-1,4-dimethyl-benzene
IUPAC Name: 2-(3-bromopropoxy)-1,4-dimethylbenzene
SYSTEMATIC NAME: 2-(3-bromanylpropoxy)-1,4-dimethyl-benzene
MOLECULAR FORMULA: C11H15BrO
MOLECULAR WEIGHT: 243.1402
SMILES: CC1=CC(=C(C=C1)C)OCCCBr
Structure:
CAS RN: 32766-64-6
CAS Name: 2-(2,5-dichloro-3-thiophenyl)-2-oxoacetic acid ethyl ester
OPENEYE Name: ethyl 2-(2,5-dichloro-3-thienyl)-2-oxo-acetate
IUPAC Name: ethyl 2-(2,5-dichlorothiophen-3-yl)-2-oxoacetate
SYSTEMATIC NAME: ethyl 2-[2,5-bis(chloranyl)thiophen-3-yl]-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C8H6Cl2O3S
MOLECULAR WEIGHT: 253.10244
SMILES: CCOC(=O)C(=O)C1=C(SC(=C1)Cl)Cl
Structure:
CAS RN: 144060-99-1
CAS Name: 2-(4-fluorophenyl)-4-methyl-5-thiazolecarboxylic acid
OPENEYE Name: 2-(4-fluorophenyl)-4-methyl-thiazole-5-carboxylic acid
IUPAC Name: 2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
SYSTEMATIC NAME: 2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
MOLECULAR FORMULA: C11H8FNO2S
MOLECULAR WEIGHT: 237.250123
SMILES: CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)O
Structure:
CAS RN: 33529-48-5
CAS Name: 4-amino-N-methoxy-N-methylbenzenesulfonamide
OPENEYE Name: 4-amino-N-methoxy-N-methyl-benzenesulfonamide
IUPAC Name: 4-amino-N-methoxy-N-methylbenzenesulfonamide
SYSTEMATIC NAME: 4-azanyl-N-methoxy-N-methyl-benzenesulfonamide
MOLECULAR FORMULA: C8H12N2O3S
MOLECULAR WEIGHT: 216.25748
SMILES: CN(OC)S(=O)(=O)C1=CC=C(C=C1)N
Structure:
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