Monday, June 27, 2011

http://ChemLookup.com Compounds




CAS RN: 225382-62-7
CAS Name: 4-chloro-6-iodothieno[3,2-d]pyrimidine
OPENEYE Name: 4-chloro-6-iodo-thieno[3,2-d]pyrimidine
IUPAC Name: 4-chloro-6-iodothieno[3,2-d]pyrimidine
SYSTEMATIC NAME: 4-chloranyl-6-iodanyl-thieno[3,2-d]pyrimidine
MOLECULAR FORMULA: C6H2ClIN2S
MOLECULAR WEIGHT: 296.51595
SMILES: C1=C(SC2=C1N=CN=C2Cl)I

CAS RN: 1214899-85-0
CAS Name: 6-bromo-1-methyl-3-indazolamine
OPENEYE Name: 6-bromo-1-methyl-indazol-3-amine
IUPAC Name: 6-bromo-1-methylindazol-3-amine
SYSTEMATIC NAME: 6-bromanyl-1-methyl-indazol-3-amine
MOLECULAR FORMULA: C8H8BrN3
MOLECULAR WEIGHT: 226.07322
SMILES: CN1C2=C(C=CC(=C2)Br)C(=N1)N

CAS RN: 1193244-87-9
CAS Name: 5-iodo-1-methyl-3-pyrazolecarboxylic acid methyl ester
OPENEYE Name: methyl 5-iodo-1-methyl-pyrazole-3-carboxylate
IUPAC Name: methyl 5-iodo-1-methylpyrazole-3-carboxylate
SYSTEMATIC NAME: methyl 5-iodanyl-1-methyl-pyrazole-3-carboxylate
MOLECULAR FORMULA: C6H7IN2O2
MOLECULAR WEIGHT: 266.03645
SMILES: CN1C(=CC(=N1)C(=O)OC)I

CAS RN: 867162-43-4
CAS Name: 2-phenyl-7-quinolinecarboxaldehyde
OPENEYE Name: 2-phenylquinoline-7-carbaldehyde
IUPAC Name: 2-phenylquinoline-7-carbaldehyde
SYSTEMATIC NAME: 2-phenylquinoline-7-carbaldehyde
MOLECULAR FORMULA: C16H11NO
MOLECULAR WEIGHT: 233.26464
SMILES: C1=CC=C(C=C1)C2=NC3=C(C=CC(=C3)C=O)C=C2

CAS RN: 1167056-91-8
CAS Name: 4-bromo-1H-indol-7-ol
OPENEYE Name: 4-bromo-1H-indol-7-ol
IUPAC Name: 4-bromo-1H-indol-7-ol
SYSTEMATIC NAME: 4-bromanyl-1H-indol-7-ol
MOLECULAR FORMULA: C8H6BrNO
MOLECULAR WEIGHT: 212.04334
SMILES: C1=CC(=C2C=CNC2=C1O)Br

CAS RN: 436091-59-7
CAS Name: 4-bromo-7-methoxy-1H-indole
OPENEYE Name: 4-bromo-7-methoxy-1H-indole
IUPAC Name: 4-bromo-7-methoxy-1H-indole
SYSTEMATIC NAME: 4-bromanyl-7-methoxy-1H-indole
MOLECULAR FORMULA: C9H8BrNO
MOLECULAR WEIGHT: 226.06992
SMILES: COC1=C2C(=C(C=C1)Br)C=CN2

CAS RN: 1029691-09-5
CAS Name: 2-amino-1,2,3,4-tetrahydrocyclopenta[b]indole-7-carbonitrile
OPENEYE Name: 2-amino-1,2,3,4-tetrahydrocyclopenta[b]indole-7-carbonitrile
IUPAC Name: 2-amino-1,2,3,4-tetrahydrocyclopenta[b]indole-7-carbonitrile
SYSTEMATIC NAME: 2-azanyl-1,2,3,4-tetrahydrocyclopenta[b]indole-7-carbonitrile
MOLECULAR FORMULA: C12H11N3
MOLECULAR WEIGHT: 197.23584
SMILES: C1C(CC2=C1C3=C(N2)C=CC(=C3)C#N)N

CAS RN: 1196037-58-7
CAS Name: 7-bromo-1,2,3,4-tetrahydrocyclopenta[b]indol-2-amine
OPENEYE Name: 7-bromo-1,2,3,4-tetrahydrocyclopenta[b]indol-2-amine
IUPAC Name: 7-bromo-1,2,3,4-tetrahydrocyclopenta[b]indol-2-amine
SYSTEMATIC NAME: 7-bromanyl-1,2,3,4-tetrahydrocyclopenta[b]indol-2-amine
MOLECULAR FORMULA: C11H11BrN2
MOLECULAR WEIGHT: 251.12244
SMILES: C1C(CC2=C1C3=C(N2)C=CC(=C3)Br)N

CAS RN: 1227845-15-9
CAS Name: (3R,4S)-4-(4-ethylphenyl)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-pyrrolidinecarboxylic acid
OPENEYE Name: (3R,4S)-1-tert-butoxycarbonyl-4-(4-ethylphenyl)pyrrolidine-3-carboxylic acid
IUPAC Name: (3R,4S)-4-(4-ethylphenyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid
SYSTEMATIC NAME: (3R,4S)-4-(4-ethylphenyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid
MOLECULAR FORMULA: C18H25NO4
MOLECULAR WEIGHT: 319.3954
SMILES: CCC1=CC=C(C=C1)[C@H]2CN(C[C@@H]2C(=O)O)C(=O)OC(C)(C)C

CAS RN: 140112-97-6
CAS Name: 5-amino-2,4-dimethylbenzoic acid methyl ester
OPENEYE Name: methyl 5-amino-2,4-dimethyl-benzoate
IUPAC Name: methyl 5-amino-2,4-dimethylbenzoate
SYSTEMATIC NAME: methyl 5-azanyl-2,4-dimethyl-benzoate
MOLECULAR FORMULA: C10H13NO2
MOLECULAR WEIGHT: 179.21572
SMILES: CC1=CC(=C(C=C1C(=O)OC)N)C

CAS RN: 328919-24-0
CAS Name: 2-(3-hydroxyphenoxy)-2-methylpropanoic acid ethyl ester
OPENEYE Name: ethyl 2-(3-hydroxyphenoxy)-2-methyl-propanoate
IUPAC Name: ethyl 2-(3-hydroxyphenoxy)-2-methylpropanoate
SYSTEMATIC NAME: ethyl 2-methyl-2-(3-oxidanylphenoxy)propanoate
MOLECULAR FORMULA: C12H16O4
MOLECULAR WEIGHT: 224.25304
SMILES: CCOC(=O)C(C)(C)OC1=CC=CC(=C1)O

CAS RN: 874821-50-8
CAS Name: [5-chloro-2-(trifluoromethoxy)phenyl]methanamine
OPENEYE Name: [5-chloro-2-(trifluoromethoxy)phenyl]methanamine
IUPAC Name: [5-chloro-2-(trifluoromethoxy)phenyl]methanamine
SYSTEMATIC NAME: [5-chloranyl-2-(trifluoromethyloxy)phenyl]methanamine
MOLECULAR FORMULA: C8H7ClF3NO
MOLECULAR WEIGHT: 225.59549
SMILES: C1=CC(=C(C=C1Cl)CN)OC(F)(F)F

CAS RN: 1092461-15-8
CAS Name: 5-chloro-2-(trifluoromethoxy)benzaldehyde
OPENEYE Name: 5-chloro-2-(trifluoromethoxy)benzaldehyde
IUPAC Name: 5-chloro-2-(trifluoromethoxy)benzaldehyde
SYSTEMATIC NAME: 5-chloranyl-2-(trifluoromethyloxy)benzaldehyde
MOLECULAR FORMULA: C8H4ClF3O2
MOLECULAR WEIGHT: 224.56437
SMILES: C1=CC(=C(C=C1Cl)C=O)OC(F)(F)F

CAS RN: 1152088-62-4
CAS Name: [5-bromo-2-(trifluoromethoxy)phenyl]methanamine
OPENEYE Name: [5-bromo-2-(trifluoromethoxy)phenyl]methanamine
IUPAC Name: [5-bromo-2-(trifluoromethoxy)phenyl]methanamine
SYSTEMATIC NAME: [5-bromanyl-2-(trifluoromethyloxy)phenyl]methanamine
MOLECULAR FORMULA: C8H7BrF3NO
MOLECULAR WEIGHT: 270.04649
SMILES: C1=CC(=C(C=C1Br)CN)OC(F)(F)F

CAS RN: 685126-86-7
CAS Name: [5-bromo-2-(trifluoromethoxy)phenyl]methanol
OPENEYE Name: [5-bromo-2-(trifluoromethoxy)phenyl]methanol
IUPAC Name: [5-bromo-2-(trifluoromethoxy)phenyl]methanol
SYSTEMATIC NAME: [5-bromanyl-2-(trifluoromethyloxy)phenyl]methanol
MOLECULAR FORMULA: C8H6BrF3O2
MOLECULAR WEIGHT: 271.03125
SMILES: C1=CC(=C(C=C1Br)CO)OC(F)(F)F

CAS RN: 858671-74-6
CAS Name: 6-bromo-1,2-benzothiazole-3-carboxylic acid ethyl ester
OPENEYE Name: ethyl 6-bromo-1,2-benzothiazole-3-carboxylate
IUPAC Name: ethyl 6-bromo-1,2-benzothiazole-3-carboxylate
SYSTEMATIC NAME: ethyl 6-bromanyl-1,2-benzothiazole-3-carboxylate
MOLECULAR FORMULA: C10H8BrNO2S
MOLECULAR WEIGHT: 286.14502
SMILES: CCOC(=O)C1=NSC2=C1C=CC(=C2)Br

CAS RN: 537041-67-1
CAS Name: N-[5-(4-chlorophenyl)-2-furanyl]-N-methylcarbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-[5-(4-chlorophenyl)-2-furyl]-N-methyl-carbamate
IUPAC Name: tert-butyl N-[5-(4-chlorophenyl)furan-2-yl]-N-methylcarbamate
SYSTEMATIC NAME: tert-butyl N-[5-(4-chlorophenyl)furan-2-yl]-N-methyl-carbamate
MOLECULAR FORMULA: C16H18ClNO3
MOLECULAR WEIGHT: 307.77202
SMILES: CC(C)(C)OC(=O)N(C)C1=CC=C(O1)C2=CC=C(C=C2)Cl

CAS RN: 37885-07-7
CAS Name: 1-[2-amino-4-(trifluoromethyl)phenyl]ethanone
OPENEYE Name: 1-[2-amino-4-(trifluoromethyl)phenyl]ethanone
IUPAC Name: 1-[2-amino-4-(trifluoromethyl)phenyl]ethanone
SYSTEMATIC NAME: 1-[2-azanyl-4-(trifluoromethyl)phenyl]ethanone
MOLECULAR FORMULA: C9H8F3NO
MOLECULAR WEIGHT: 203.16113
SMILES: CC(=O)C1=C(C=C(C=C1)C(F)(F)F)N

CAS RN: 87472-99-9
CAS Name: 1-(2-amino-4-phenylmethoxy-3-propylphenyl)ethanone
OPENEYE Name: 1-(2-amino-4-benzyloxy-3-propyl-phenyl)ethanone
IUPAC Name: 1-(2-amino-4-phenylmethoxy-3-propylphenyl)ethanone
SYSTEMATIC NAME: 1-(2-azanyl-4-phenylmethoxy-3-propyl-phenyl)ethanone
MOLECULAR FORMULA: C18H21NO2
MOLECULAR WEIGHT: 283.36484
SMILES: CCCC1=C(C=CC(=C1N)C(=O)C)OCC2=CC=CC=C2

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