Sunday, June 26, 2011

http://ChemLookup.com Compounds




CAS RN: 1120214-89-2
CAS Name: 3-bromo-7-imidazo[1,2-a]pyridinamine
OPENEYE Name: 3-bromoimidazo[1,2-a]pyridin-7-amine
IUPAC Name: 3-bromoimidazo[1,2-a]pyridin-7-amine
SYSTEMATIC NAME: 3-bromanylimidazo[1,2-a]pyridin-7-amine
MOLECULAR FORMULA: C7H6BrN3
MOLECULAR WEIGHT: 212.04664
SMILES: C1=CN2C(=NC=C2Br)C=C1N

CAS RN: 56634-50-5
CAS Name: 4-bromo-3H-furan-2-one
OPENEYE Name: 4-bromo-3H-furan-2-one
IUPAC Name: 4-bromo-3H-furan-2-one
SYSTEMATIC NAME: 4-bromanyl-3H-furan-2-one
MOLECULAR FORMULA: C4H3BrO2
MOLECULAR WEIGHT: 162.96942
SMILES: C1C(=COC1=O)Br

CAS RN: 163163-79-9
CAS Name: 5-bromo-6-(1-methoxyethoxy)-3-pyridinecarboxaldehyde
OPENEYE Name: 5-bromo-6-(1-methoxyethoxy)pyridine-3-carbaldehyde
IUPAC Name: 5-bromo-6-(1-methoxyethoxy)pyridine-3-carbaldehyde
SYSTEMATIC NAME: 5-bromanyl-6-(1-methoxyethoxy)pyridine-3-carbaldehyde
MOLECULAR FORMULA: C9H10BrNO3
MOLECULAR WEIGHT: 260.0846
SMILES: CC(OC)OC1=C(C=C(C=N1)C=O)Br

CAS RN: 1173360-91-2
CAS Name: 2-bromo-4-fluoro-1-[(Z)-2-nitroethenyl]benzene
OPENEYE Name: 2-bromo-4-fluoro-1-[(Z)-2-nitrovinyl]benzene
IUPAC Name: 2-bromo-4-fluoro-1-[(Z)-2-nitroethenyl]benzene
SYSTEMATIC NAME: 2-bromanyl-4-fluoranyl-1-[(Z)-2-nitroethenyl]benzene
MOLECULAR FORMULA: C8H5BrFNO2
MOLECULAR WEIGHT: 246.033203
SMILES: C1=CC(=C(C=C1F)Br)/C=C\[N+](=O)[O-]

CAS RN: 917969-51-8
CAS Name: 4-bromo-2-fluoro-3-iodopyridine
OPENEYE Name: 4-bromo-2-fluoro-3-iodo-pyridine
IUPAC Name: 4-bromo-2-fluoro-3-iodopyridine
SYSTEMATIC NAME: 4-bromanyl-2-fluoranyl-3-iodanyl-pyridine
MOLECULAR FORMULA: C5H2BrFIN
MOLECULAR WEIGHT: 301.882953
SMILES: C1=CN=C(C(=C1Br)I)F

CAS RN: 1000576-47-5
CAS Name: [bromo(cyclopropylmethyl)-$l^{3}-sulfanyl]benzene
OPENEYE Name: [bromo(cyclopropylmethyl)-$l^{3}-sulfanyl]benzene
IUPAC Name: [bromo(cyclopropylmethyl)-$l^{3}-sulfanyl]benzene
SYSTEMATIC NAME: [bromanyl(cyclopropylmethyl)-$l^{3}-sulfanyl]benzene
MOLECULAR FORMULA: C10H12BrS
MOLECULAR WEIGHT: 244.17128
SMILES: C1CC1C[S](C2=CC=CC=C2)Br

CAS RN: 821773-99-3
CAS Name: (5-bromo-2-chloro-4-pyridinyl)-tributylstannane
OPENEYE Name: (5-bromo-2-chloro-4-pyridyl)-tributyl-stannane
IUPAC Name: (5-bromo-2-chloropyridin-4-yl)-tributylstannane
SYSTEMATIC NAME: (5-bromanyl-2-chloranyl-pyridin-4-yl)-tributyl-stannane
MOLECULAR FORMULA: C17H29BrClNSn
MOLECULAR WEIGHT: 481.48586
SMILES: CCCC[Sn](CCCC)(CCCC)C1=CC(=NC=C1Br)Cl

CAS RN: 29064-76-4
CAS Name: 7-bromo-4-chlorothieno[3,2-c]pyridine
OPENEYE Name: 7-bromo-4-chloro-thieno[3,2-c]pyridine
IUPAC Name: 7-bromo-4-chlorothieno[3,2-c]pyridine
SYSTEMATIC NAME: 7-bromanyl-4-chloranyl-thieno[3,2-c]pyridine
MOLECULAR FORMULA: C7H3BrClNS
MOLECULAR WEIGHT: 248.52742
SMILES: C1=CSC2=C1C(=NC=C2Br)Cl

CAS RN: 956003-79-5
CAS Name: 5-bromo-8-chloroisoquinoline
OPENEYE Name: 5-bromo-8-chloro-isoquinoline
IUPAC Name: 5-bromo-8-chloroisoquinoline
SYSTEMATIC NAME: 5-bromanyl-8-chloranyl-isoquinoline
MOLECULAR FORMULA: C9H5BrClN
MOLECULAR WEIGHT: 242.4997
SMILES: C1=CC(=C2C=CN=CC2=C1Cl)Br

CAS RN: 1105187-43-6
CAS Name: 7-bromo-4-chlorofuro[3,2-c]pyridine
OPENEYE Name: 7-bromo-4-chloro-furo[3,2-c]pyridine
IUPAC Name: 7-bromo-4-chlorofuro[3,2-c]pyridine
SYSTEMATIC NAME: 7-bromanyl-4-chloranyl-furo[3,2-c]pyridine
MOLECULAR FORMULA: C7H3BrClNO
MOLECULAR WEIGHT: 232.46182
SMILES: C1=COC2=C1C(=NC=C2Br)Cl

CAS RN: 243972-26-1
CAS Name: 5-tributylstannyl-2-thiazolecarboxylic acid tert-butyl ester
OPENEYE Name: tert-butyl 5-tributylstannylthiazole-2-carboxylate
IUPAC Name: tert-butyl 5-tributylstannyl-1,3-thiazole-2-carboxylate
SYSTEMATIC NAME: tert-butyl 5-tributylstannyl-1,3-thiazole-2-carboxylate
MOLECULAR FORMULA: C20H37NO2SSn
MOLECULAR WEIGHT: 474.28828
SMILES: CCCC[Sn](CCCC)(CCCC)C1=CN=C(S1)C(=O)OC(C)(C)C

CAS RN: 1005207-32-8
CAS Name: [4-(phenylmethyl)-2-thiophenyl]boronic acid
OPENEYE Name: (4-benzyl-2-thienyl)boronic acid
IUPAC Name: (4-benzylthiophen-2-yl)boronic acid
SYSTEMATIC NAME: [4-(phenylmethyl)thiophen-2-yl]boronic acid
MOLECULAR FORMULA: C11H11BO2S
MOLECULAR WEIGHT: 218.07984
SMILES: B(C1=CC(=CS1)CC2=CC=CC=C2)(O)O

CAS RN: 1160995-15-2
CAS Name: 6-(phenylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxylic acid
OPENEYE Name: 6-benzyl-7,8-dihydro-5H-1,6-naphthyridine-2-carboxylic acid
IUPAC Name: 6-benzyl-7,8-dihydro-5H-1,6-naphthyridine-2-carboxylic acid
SYSTEMATIC NAME: 6-(phenylmethyl)-7,8-dihydro-5H-1,6-naphthyridine-2-carboxylic acid
MOLECULAR FORMULA: C16H16N2O2
MOLECULAR WEIGHT: 268.31044
SMILES: C1CN(CC2=C1N=C(C=C2)C(=O)O)CC3=CC=CC=C3

CAS RN: 909187-64-0
CAS Name: 6-(phenylmethyl)-2,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-3-one
OPENEYE Name: 6-benzyl-2,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-3-one
IUPAC Name: 6-benzyl-2,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-3-one
SYSTEMATIC NAME: 6-(phenylmethyl)-2,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-3-one
MOLECULAR FORMULA: C13H15N3O
MOLECULAR WEIGHT: 229.2777
SMILES: C1CN(CC2=C1C(=O)NN2)CC3=CC=CC=C3

CAS RN: 1059735-34-0
CAS Name: 2,4-dichloro-7-(phenylmethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
OPENEYE Name: 7-benzyl-2,4-dichloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
IUPAC Name: 7-benzyl-2,4-dichloro-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
SYSTEMATIC NAME: 2,4-bis(chloranyl)-7-(phenylmethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
MOLECULAR FORMULA: C14H13Cl2N3
MOLECULAR WEIGHT: 294.17912
SMILES: C1CN(CC2=C1C(=NC(=N2)Cl)Cl)CC3=CC=CC=C3

CAS RN: 1104027-46-4
CAS Name: 5-chloro-2-(phenylmethyl)-3,4-dihydro-1H-2,6-naphthyridine
OPENEYE Name: 2-benzyl-5-chloro-3,4-dihydro-1H-2,6-naphthyridine
IUPAC Name: 2-benzyl-5-chloro-3,4-dihydro-1H-2,6-naphthyridine
SYSTEMATIC NAME: 5-chloranyl-2-(phenylmethyl)-3,4-dihydro-1H-2,6-naphthyridine
MOLECULAR FORMULA: C15H15ClN2
MOLECULAR WEIGHT: 258.746
SMILES: C1CN(CC2=C1C(=NC=C2)Cl)CC3=CC=CC=C3

CAS RN: 1105187-42-5
CAS Name: 2-amino-5,7-dihydropyrrolo[3,4-d]pyrimidine-6-carboxylic acid tert-butyl ester
OPENEYE Name: tert-butyl 2-amino-5,7-dihydropyrrolo[3,4-d]pyrimidine-6-carboxylate
IUPAC Name: tert-butyl 2-amino-5,7-dihydropyrrolo[3,4-d]pyrimidine-6-carboxylate
SYSTEMATIC NAME: tert-butyl 2-azanyl-5,7-dihydropyrrolo[3,4-d]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C11H16N4O2
MOLECULAR WEIGHT: 236.27034
SMILES: CC(C)(C)OC(=O)N1CC2=CN=C(N=C2C1)N

CAS RN: 1105187-46-9
CAS Name: 2-(5-amino-2-indazolyl)ethanol
OPENEYE Name: 2-(5-aminoindazol-2-yl)ethanol
IUPAC Name: 2-(5-aminoindazol-2-yl)ethanol
SYSTEMATIC NAME: 2-(5-azanylindazol-2-yl)ethanol
MOLECULAR FORMULA: C9H11N3O
MOLECULAR WEIGHT: 177.20314
SMILES: C1=CC2=NN(C=C2C=C1N)CCO

CAS RN: 916420-33-2
CAS Name: 2,2-dimethylene-3,4-dihydro-1H-2-benzothiopyran-4-amine
OPENEYE Name: 2,2-dimethylene-3,4-dihydro-1H-isothiochromen-4-amine
IUPAC Name: 2,2-dimethylidene-3,4-dihydro-1H-isothiochromen-4-amine
SYSTEMATIC NAME: 2,2-dimethylidene-3,4-dihydro-1H-isothiochromen-4-amine
MOLECULAR FORMULA: C11H15NS
MOLECULAR WEIGHT: 193.3085
SMILES: C=S1(=C)CC(C2=CC=CC=C2C1)N

CAS RN: 874903-79-4
CAS Name: 4-(6-amino-8-bromo-9-purinyl)butanoate
OPENEYE Name: 4-(6-amino-8-bromo-purin-9-yl)butanoate
IUPAC Name: 4-(6-amino-8-bromopurin-9-yl)butanoate
SYSTEMATIC NAME: 4-(6-azanyl-8-bromanyl-purin-9-yl)butanoate
MOLECULAR FORMULA: C9H9BrN5O2-
MOLECULAR WEIGHT: 299.10406
SMILES: C1=NC2=C(C(=N1)N)N=C(N2CCCC(=O)[O-])Br

CAS RN: 182125-23-1
CAS Name: 5-(3-aminopropyl)-2H-1,3,4-thiadiazol-3-amine
OPENEYE Name: 5-(3-aminopropyl)-2H-1,3,4-thiadiazol-3-amine
IUPAC Name: 5-(3-aminopropyl)-2H-1,3,4-thiadiazol-3-amine
SYSTEMATIC NAME: 5-(3-azanylpropyl)-2H-1,3,4-thiadiazol-3-amine
MOLECULAR FORMULA: C5H12N4S
MOLECULAR WEIGHT: 160.24058
SMILES: C1N(N=C(S1)CCCN)N

CAS RN: 106840-37-3
CAS Name: 1-acetyl-1$l^{3},2,5-thiadiazole-3-carboxylic acid ethyl ester
OPENEYE Name: ethyl 1-acetyl-1$l^{3},2,5-thiadiazole-3-carboxylate
IUPAC Name: ethyl 1-acetyl-1$l^{3},2,5-thiadiazole-3-carboxylate
SYSTEMATIC NAME: ethyl 1-ethanoyl-1$l^{3},2,5-thiadiazole-3-carboxylate
MOLECULAR FORMULA: C7H9N2O3S
MOLECULAR WEIGHT: 201.22296
SMILES: CCOC(=O)C1=N[S](N=C1)C(=O)C

CAS RN: 1170060-19-1
CAS Name: 4-acetyl-1,2,5-thiadiazole-3-carboxylic acid
OPENEYE Name: 4-acetyl-1,2,5-thiadiazole-3-carboxylic acid
IUPAC Name: 4-acetyl-1,2,5-thiadiazole-3-carboxylic acid
SYSTEMATIC NAME: 4-ethanoyl-1,2,5-thiadiazole-3-carboxylic acid
MOLECULAR FORMULA: C5H4N2O3S
MOLECULAR WEIGHT: 172.16186
SMILES: CC(=O)C1=NSN=C1C(=O)O

CAS RN: 66494-26-6
CAS Name: 1-[formyl-[(2-methylpropan-2-yl)oxy]amino]-1-cyclopropanecarboxylic acid methyl ester
OPENEYE Name: methyl 1-[tert-butoxy(formyl)amino]cyclopropanecarboxylate
IUPAC Name: methyl 1-[formyl-[(2-methylpropan-2-yl)oxy]amino]cyclopropane-1-carboxylate
SYSTEMATIC NAME: methyl 1-[methanoyl-[(2-methylpropan-2-yl)oxy]amino]cyclopropane-1-carboxylate
MOLECULAR FORMULA: C10H17NO4
MOLECULAR WEIGHT: 215.24628
SMILES: CC(C)(C)ON(C=O)C1(CC1)C(=O)OC

CAS RN: 306298-24-8
CAS Name: 4-[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methyl-1-piperazinecarboxylic acid tert-butyl ester
OPENEYE Name: tert-butyl 4-[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methyl-piperazine-1-carboxylate
IUPAC Name: tert-butyl 4-[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methylpiperazine-1-carboxylate
SYSTEMATIC NAME: tert-butyl 4-[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methyl-piperazine-1-carboxylate
MOLECULAR FORMULA: C20H29F3N2O3
MOLECULAR WEIGHT: 402.45107
SMILES: CC1CN(CCN1[C@@H](COC)C2=CC=C(C=C2)C(F)(F)F)C(=O)OC(C)(C)C

CAS RN: 612494-07-2
CAS Name: 1-[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl]-2-methylpiperazine
OPENEYE Name: 1-[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl]-2-methyl-piperazine
IUPAC Name: 1-[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl]-2-methylpiperazine
SYSTEMATIC NAME: 1-[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl]-2-methyl-piperazine
MOLECULAR FORMULA: C15H21F3N2O
MOLECULAR WEIGHT: 302.33525
SMILES: CC1CNCCN1[C@@H](COC)C2=CC=C(C=C2)C(F)(F)F

CAS RN: 36159-47-4
CAS Name: (1S,4aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-ol
OPENEYE Name: (1S,4aS)-decalin-1-ol
IUPAC Name: (1S,4aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-ol
SYSTEMATIC NAME: (1S,4aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-ol
MOLECULAR FORMULA: C10H18O
MOLECULAR WEIGHT: 154.24932
SMILES: C1CCC2[C@@H](C1)CCC[C@@H]2O

CAS RN: 18827-81-1
CAS Name: carbanide; iridium
OPENEYE Name: carbanide; iridium
IUPAC Name: carbanide; iridium
SYSTEMATIC NAME: carbanide; iridium
MOLECULAR FORMULA: CH3Ir-
MOLECULAR WEIGHT: 207.25152
SMILES: [CH3-].[Ir]

CAS RN: 1131614-92-0
CAS Name: 3-iodo-4-(1-phenylethoxy)benzoic acid
OPENEYE Name: 3-iodo-4-(1-phenylethoxy)benzoic acid
IUPAC Name: 3-iodo-4-(1-phenylethoxy)benzoic acid
SYSTEMATIC NAME: 3-iodanyl-4-(1-phenylethoxy)benzoic acid
MOLECULAR FORMULA: C15H13IO3
MOLECULAR WEIGHT: 368.16639
SMILES: CC(C1=CC=CC=C1)OC2=C(C=C(C=C2)C(=O)O)I

CAS RN: 139078-63-0
CAS Name: 4-[(3,3-dimethyl-1-oxobutyl)amino]-3-iodobenzoic acid
OPENEYE Name: 4-(3,3-dimethylbutanoylamino)-3-iodo-benzoic acid
IUPAC Name: 4-(3,3-dimethylbutanoylamino)-3-iodobenzoic acid
SYSTEMATIC NAME: 4-(3,3-dimethylbutanoylamino)-3-iodanyl-benzoic acid
MOLECULAR FORMULA: C13H16INO3
MOLECULAR WEIGHT: 361.17551
SMILES: CC(C)(C)CC(=O)NC1=C(C=C(C=C1)C(=O)O)I

CAS RN: 1131605-46-3
CAS Name: 2-amino-5-iodobenzoic acid [(E)-hex-3-enyl] ester
OPENEYE Name: [(E)-hex-3-enyl] 2-amino-5-iodo-benzoate
IUPAC Name: [(E)-hex-3-enyl] 2-amino-5-iodobenzoate
SYSTEMATIC NAME: [(E)-hex-3-enyl] 2-azanyl-5-iodanyl-benzoate
MOLECULAR FORMULA: C13H16INO2
MOLECULAR WEIGHT: 345.17611
SMILES: CC/C=C/CCOC(=O)C1=C(C=CC(=C1)I)N

CAS RN: 186537-58-6
CAS Name: (2R)-3-(carboxythio)-2-(methylamino)propanoic acid
OPENEYE Name: (2R)-3-carboxysulfanyl-2-(methylamino)propanoic acid
IUPAC Name: (2R)-3-carboxysulfanyl-2-(methylamino)propanoic acid
SYSTEMATIC NAME: (2R)-3-carboxysulfanyl-2-(methylamino)propanoic acid
MOLECULAR FORMULA: C5H9NO4S
MOLECULAR WEIGHT: 179.19426
SMILES: CN[C@@H](CSC(=O)O)C(=O)O

CAS RN: 171663-00-6
CAS Name: 3-[3-[[formyl-[(2-methylpropan-2-yl)oxy]amino]methyl]phenyl]propanoic acid
OPENEYE Name: 3-[3-[[tert-butoxy(formyl)amino]methyl]phenyl]propanoic acid
IUPAC Name: 3-[3-[[formyl-[(2-methylpropan-2-yl)oxy]amino]methyl]phenyl]propanoic acid
SYSTEMATIC NAME: 3-[3-[[methanoyl-[(2-methylpropan-2-yl)oxy]amino]methyl]phenyl]propanoic acid
MOLECULAR FORMULA: C15H21NO4
MOLECULAR WEIGHT: 279.33154
SMILES: CC(C)(C)ON(CC1=CC=CC(=C1)CCC(=O)O)C=O

CAS RN: 132691-45-3
CAS Name: 3-[4-[[formyl-[(2-methylpropan-2-yl)oxy]amino]methyl]phenyl]propanoic acid
OPENEYE Name: 3-[4-[[tert-butoxy(formyl)amino]methyl]phenyl]propanoic acid
IUPAC Name: 3-[4-[[formyl-[(2-methylpropan-2-yl)oxy]amino]methyl]phenyl]propanoic acid
SYSTEMATIC NAME: 3-[4-[[methanoyl-[(2-methylpropan-2-yl)oxy]amino]methyl]phenyl]propanoic acid
MOLECULAR FORMULA: C15H21NO4
MOLECULAR WEIGHT: 279.33154
SMILES: CC(C)(C)ON(CC1=CC=C(C=C1)CCC(=O)O)C=O

CAS RN: 436867-71-9
CAS Name: 1-amino-3-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-piperidinecarboxylic acid
OPENEYE Name: 1-amino-3-tert-butoxycarbonyl-piperidine-3-carboxylic acid
IUPAC Name: 1-amino-3-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid
SYSTEMATIC NAME: 1-azanyl-3-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid
MOLECULAR FORMULA: C11H20N2O4
MOLECULAR WEIGHT: 244.2875
SMILES: CC(C)(C)OC(=O)C1(CCCN(C1)N)C(=O)O

CAS RN: 91189-18-3
CAS Name: 2-amino-1-(diphenylmethyl)-3-azetidinecarboxylic acid tert-butyl ester
OPENEYE Name: tert-butyl 2-amino-1-benzhydryl-azetidine-3-carboxylate
IUPAC Name: tert-butyl 2-amino-1-benzhydrylazetidine-3-carboxylate
SYSTEMATIC NAME: tert-butyl 2-azanyl-1-(diphenylmethyl)azetidine-3-carboxylate
MOLECULAR FORMULA: C21H26N2O2
MOLECULAR WEIGHT: 338.44334
SMILES: CC(C)(C)OC(=O)C1CN(C1N)C(C2=CC=CC=C2)C3=CC=CC=C3

CAS RN: 959579-94-3
CAS Name: (1S,2S)-4-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-(4-nitrophenyl)-1-cyclopentanecarboxylic acid
OPENEYE Name: (1S,2S)-4-tert-butoxycarbonyl-2-(4-nitrophenyl)cyclopentanecarboxylic acid
IUPAC Name: (1S,2S)-4-[(2-methylpropan-2-yl)oxycarbonyl]-2-(4-nitrophenyl)cyclopentane-1-carboxylic acid
SYSTEMATIC NAME: (1S,2S)-4-[(2-methylpropan-2-yl)oxycarbonyl]-2-(4-nitrophenyl)cyclopentane-1-carboxylic acid
MOLECULAR FORMULA: C17H21NO6
MOLECULAR WEIGHT: 335.35174
SMILES: CC(C)(C)OC(=O)C1C[C@@H]([C@H](C1)C(=O)O)C2=CC=C(C=C2)[N+](=O)[O-]

CAS RN: 959577-51-6
CAS Name: (3R)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-(2-nitrophenyl)-3-pyrrolidinecarboxylic acid
OPENEYE Name: (3R)-1-tert-butoxycarbonyl-4-(2-nitrophenyl)pyrrolidine-3-carboxylic acid
IUPAC Name: (3R)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(2-nitrophenyl)pyrrolidine-3-carboxylic acid
SYSTEMATIC NAME: (3R)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(2-nitrophenyl)pyrrolidine-3-carboxylic acid
MOLECULAR FORMULA: C16H20N2O6
MOLECULAR WEIGHT: 336.3398
SMILES: CC(C)(C)OC(=O)N1C[C@@H](C(C1)C2=CC=CC=C2[N+](=O)[O-])C(=O)O

CAS RN: 698359-62-5
CAS Name: 4-(4-methoxyphenyl)-1-(phenylmethyl)-3-pyrrolidinecarboxylic acid hydrochloride
OPENEYE Name: 1-benzyl-4-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid hydrochloride
IUPAC Name: 1-benzyl-4-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid hydrochloride
SYSTEMATIC NAME: 4-(4-methoxyphenyl)-1-(phenylmethyl)pyrrolidine-3-carboxylic acid hydrochloride
MOLECULAR FORMULA: C19H22ClNO3
MOLECULAR WEIGHT: 347.83588
SMILES: COC1=CC=C(C=C1)C2CN(CC2C(=O)O)CC3=CC=CC=C3.Cl

CAS RN: 154205-78-4
CAS Name: (3R)-4-(2-methoxyphenyl)-1-(phenylmethyl)-3-pyrrolidinecarboxylic acid
OPENEYE Name: (3R)-1-benzyl-4-(2-methoxyphenyl)pyrrolidine-3-carboxylic acid
IUPAC Name: (3R)-1-benzyl-4-(2-methoxyphenyl)pyrrolidine-3-carboxylic acid
SYSTEMATIC NAME: (3R)-4-(2-methoxyphenyl)-1-(phenylmethyl)pyrrolidine-3-carboxylic acid
MOLECULAR FORMULA: C19H21NO3
MOLECULAR WEIGHT: 311.37494
SMILES: COC1=CC=CC=C1C2CN(C[C@@H]2C(=O)O)CC3=CC=CC=C3

CAS RN: 169248-95-7
CAS Name: 4-[3-(trifluoromethyl)phenyl]-3-pyrrolidinecarboxylic acid methyl ester
OPENEYE Name: methyl 4-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate
IUPAC Name: methyl 4-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate
SYSTEMATIC NAME: methyl 4-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate
MOLECULAR FORMULA: C13H14F3NO2
MOLECULAR WEIGHT: 273.25097
SMILES: COC(=O)C1CNCC1C2=CC(=CC=C2)C(F)(F)F

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