Friday, February 24, 2012

http://ChemLookup.com Compounds




CAS RN: 67466-49-3
CAS Name: 3-(3,4-dichlorophenyl)-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(3,4-dichlorophenyl)pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(3,4-dichlorophenyl)pyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(3,4-dichlorophenyl)pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C10H12Cl3NO
MOLECULAR WEIGHT: 268.56738
SMILES: C1CNCC1(C2=CC(=C(C=C2)Cl)Cl)O.Cl
Structure:

CAS RN: 67466-48-2
CAS Name: 3-cyclohexyl-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-cyclohexylpyrrolidin-3-ol hydrochloride
IUPAC Name: 3-cyclohexylpyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-cyclohexylpyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C10H20ClNO
MOLECULAR WEIGHT: 205.7249
SMILES: C1CCC(CC1)C2(CCNC2)O.Cl
Structure:

CAS RN: 67466-47-1
CAS Name: 5-(4-chlorophenyl)-3-phenyl-3-pyrrolidinol hydrochloride
OPENEYE Name: 5-(4-chlorophenyl)-3-phenyl-pyrrolidin-3-ol hydrochloride
IUPAC Name: 5-(4-chlorophenyl)-3-phenylpyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 5-(4-chlorophenyl)-3-phenyl-pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C16H17Cl2NO
MOLECULAR WEIGHT: 310.21828
SMILES: C1C(NCC1(C2=CC=CC=C2)O)C3=CC=C(C=C3)Cl.Cl
Structure:

CAS RN: 67466-46-0
CAS Name: 3-(4-chlorophenyl)-5-phenyl-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(4-chlorophenyl)-5-phenyl-pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(4-chlorophenyl)-5-phenylpyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(4-chlorophenyl)-5-phenyl-pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C16H17Cl2NO
MOLECULAR WEIGHT: 310.21828
SMILES: C1C(NCC1(C2=CC=C(C=C2)Cl)O)C3=CC=CC=C3.Cl
Structure:

CAS RN: 67466-45-9
CAS Name: 3-(4-chlorophenyl)-5-methyl-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(4-chlorophenyl)-5-methyl-pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(4-chlorophenyl)-5-methylpyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(4-chlorophenyl)-5-methyl-pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C11H15Cl2NO
MOLECULAR WEIGHT: 248.1489
SMILES: CC1CC(CN1)(C2=CC=C(C=C2)Cl)O.Cl
Structure:

CAS RN: 67466-44-8
CAS Name: 3-(4-chlorophenyl)-2-methyl-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(4-chlorophenyl)-2-methyl-pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(4-chlorophenyl)-2-methylpyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(4-chlorophenyl)-2-methyl-pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C11H15Cl2NO
MOLECULAR WEIGHT: 248.1489
SMILES: CC1C(CCN1)(C2=CC=C(C=C2)Cl)O.Cl
Structure:

CAS RN: 67466-43-7
CAS Name: 3-(3-chlorophenyl)-5-methyl-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(3-chlorophenyl)-5-methyl-pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(3-chlorophenyl)-5-methylpyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(3-chlorophenyl)-5-methyl-pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C11H15Cl2NO
MOLECULAR WEIGHT: 248.1489
SMILES: CC1CC(CN1)(C2=CC(=CC=C2)Cl)O.Cl
Structure:

CAS RN: 67466-42-6
CAS Name: 3-(3-chlorophenyl)-2-methyl-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(3-chlorophenyl)-2-methyl-pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(3-chlorophenyl)-2-methylpyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(3-chlorophenyl)-2-methyl-pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C11H15Cl2NO
MOLECULAR WEIGHT: 248.1489
SMILES: CC1C(CCN1)(C2=CC(=CC=C2)Cl)O.Cl
Structure:

CAS RN: 67466-41-5
CAS Name: 3-(4-chlorophenyl)-5-propan-2-yl-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(4-chlorophenyl)-5-isopropyl-pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(4-chlorophenyl)-5-propan-2-ylpyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(4-chlorophenyl)-5-propan-2-yl-pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C13H19Cl2NO
MOLECULAR WEIGHT: 276.20206
SMILES: CC(C)C1CC(CN1)(C2=CC=C(C=C2)Cl)O.Cl
Structure:

CAS RN: 67466-40-4
CAS Name: 3-(4-chlorophenyl)-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(4-chlorophenyl)pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(4-chlorophenyl)pyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(4-chlorophenyl)pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C10H13Cl2NO
MOLECULAR WEIGHT: 234.12232
SMILES: C1CNCC1(C2=CC=C(C=C2)Cl)O.Cl
Structure:

CAS RN: 67466-39-1
CAS Name: 3-(2-chlorophenyl)-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(2-chlorophenyl)pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(2-chlorophenyl)pyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(2-chlorophenyl)pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C10H13Cl2NO
MOLECULAR WEIGHT: 234.12232
SMILES: C1CNCC1(C2=CC=CC=C2Cl)O.Cl
Structure:

CAS RN: 67466-38-0
CAS Name: 3-(3-chlorophenyl)-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(3-chlorophenyl)pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(3-chlorophenyl)pyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(3-chlorophenyl)pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C10H13Cl2NO
MOLECULAR WEIGHT: 234.12232
SMILES: C1CNCC1(C2=CC(=CC=C2)Cl)O.Cl
Structure:

CAS RN: 67466-37-9
CAS Name: 3-(4-chlorophenyl)-2-ethyl-5-methyl-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(4-chlorophenyl)-2-ethyl-5-methyl-pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(4-chlorophenyl)-2-ethyl-5-methylpyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(4-chlorophenyl)-2-ethyl-5-methyl-pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C13H19Cl2NO
MOLECULAR WEIGHT: 276.20206
SMILES: CCC1C(CC(N1)C)(C2=CC=C(C=C2)Cl)O.Cl
Structure:

CAS RN: 67466-36-8
CAS Name: 3-(4-chlorophenyl)-5-ethyl-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(4-chlorophenyl)-5-ethyl-pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(4-chlorophenyl)-5-ethylpyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(4-chlorophenyl)-5-ethyl-pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C12H17Cl2NO
MOLECULAR WEIGHT: 262.17548
SMILES: CCC1CC(CN1)(C2=CC=C(C=C2)Cl)O.Cl
Structure:

CAS RN: 67466-35-7
CAS Name: 3-(4-chlorophenyl)-2-ethyl-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(4-chlorophenyl)-2-ethyl-pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(4-chlorophenyl)-2-ethylpyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(4-chlorophenyl)-2-ethyl-pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C12H17Cl2NO
MOLECULAR WEIGHT: 262.17548
SMILES: CCC1C(CCN1)(C2=CC=C(C=C2)Cl)O.Cl
Structure:

CAS RN: 67466-34-6
CAS Name: 3-(4-chlorophenyl)-2,5-dimethyl-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(4-chlorophenyl)-2,5-dimethyl-pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(4-chlorophenyl)-2,5-dimethylpyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(4-chlorophenyl)-2,5-dimethyl-pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C12H17Cl2NO
MOLECULAR WEIGHT: 262.17548
SMILES: CC1CC(C(N1)C)(C2=CC=C(C=C2)Cl)O.Cl
Structure:

CAS RN: 67466-33-5
CAS Name: 3-[(4-chlorophenyl)methyl]-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-[(4-chlorophenyl)methyl]pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-[(4-chlorophenyl)methyl]pyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-[(4-chlorophenyl)methyl]pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C11H15Cl2NO
MOLECULAR WEIGHT: 248.1489
SMILES: C1CNCC1(CC2=CC=C(C=C2)Cl)O.Cl
Structure:

CAS RN: 67466-32-4
CAS Name: 3-(4-bromophenyl)-5-methyl-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(4-bromophenyl)-5-methyl-pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(4-bromophenyl)-5-methylpyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(4-bromophenyl)-5-methyl-pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C11H15BrClNO
MOLECULAR WEIGHT: 292.5999
SMILES: CC1CC(CN1)(C2=CC=C(C=C2)Br)O.Cl
Structure:

CAS RN: 67466-31-3
CAS Name: 3-(4-bromophenyl)-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(4-bromophenyl)pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(4-bromophenyl)pyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(4-bromophenyl)pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C10H13BrClNO
MOLECULAR WEIGHT: 278.57332
SMILES: C1CNCC1(C2=CC=C(C=C2)Br)O.Cl
Structure:

CAS RN: 67466-30-2
CAS Name: 2-methyl-1-[6-(2-methyl-2-pyrrolidinyl)hexyl]pyrrolidine
OPENEYE Name: 2-methyl-1-[6-(2-methylpyrrolidin-2-yl)hexyl]pyrrolidine
IUPAC Name: 2-methyl-1-[6-(2-methylpyrrolidin-2-yl)hexyl]pyrrolidine
SYSTEMATIC NAME: 2-methyl-1-[6-(2-methylpyrrolidin-2-yl)hexyl]pyrrolidine
MOLECULAR FORMULA: C16H32N2
MOLECULAR WEIGHT: 252.43868
SMILES: CC1CCCN1CCCCCCC2(CCCN2)C
Structure:

CAS RN: 67466-29-9
CAS Name: 6-(5-methyl-2-pyrrolidinyl)-1-hexanamine
OPENEYE Name: 6-(5-methylpyrrolidin-2-yl)hexan-1-amine
IUPAC Name: 6-(5-methylpyrrolidin-2-yl)hexan-1-amine
SYSTEMATIC NAME: 6-(5-methylpyrrolidin-2-yl)hexan-1-amine
MOLECULAR FORMULA: C11H24N2
MOLECULAR WEIGHT: 184.32166
SMILES: CC1CCC(N1)CCCCCCN
Structure:

CAS RN: 67466-28-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C28H17NO4
MOLECULAR WEIGHT: 431.43888
SMILES: C1=CC=C2C(=C1)C=CC3=C4C5C(C(=C32)C6=C4C7=CC=CC=C7C=C6)C(=O)N(C5=O)CC(=O)O
Structure:

CAS RN: 67466-27-7
CAS Name: 3,4,5-trimethoxybenzoic acid 4-[ethyl-[2-(1H-pyrrol-2-yl)ethyl]amino]butyl ester
OPENEYE Name: 4-[ethyl-[2-(1H-pyrrol-2-yl)ethyl]amino]butyl 3,4,5-trimethoxybenzoate
IUPAC Name: 4-[ethyl-[2-(1H-pyrrol-2-yl)ethyl]amino]butyl 3,4,5-trimethoxybenzoate
SYSTEMATIC NAME: 4-[ethyl-[2-(1H-pyrrol-2-yl)ethyl]amino]butyl 3,4,5-trimethoxybenzoate
MOLECULAR FORMULA: C22H32N2O5
MOLECULAR WEIGHT: 404.49988
SMILES: CCN(CCCCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC)CCC2=CC=CN2
Structure:

CAS RN: 67466-23-3
CAS Name: 2-[2,4,6-trioxo-5,5-bis(prop-2-enyl)-1,3-diazinan-1-yl]acetic acid ethyl ester
OPENEYE Name: ethyl 2-(5,5-diallyl-2,4,6-trioxo-hexahydropyrimidin-1-yl)acetate
IUPAC Name: ethyl 2-[2,4,6-trioxo-5,5-bis(prop-2-enyl)-1,3-diazinan-1-yl]acetate
SYSTEMATIC NAME: ethyl 2-[2,4,6-tris(oxidanylidene)-5,5-bis(prop-2-enyl)-1,3-diazinan-1-yl]ethanoate
MOLECULAR FORMULA: C14H18N2O5
MOLECULAR WEIGHT: 294.30312
SMILES: CCOC(=O)CN1C(=O)C(C(=O)NC1=O)(CC=C)CC=C
Structure:

CAS RN: 67466-14-2
CAS Name: 5-methyl-6-pentylpyrido[2,3-d]pyrimidine-2,4-diamine
OPENEYE Name: 5-methyl-6-pentyl-pyrido[2,3-d]pyrimidine-2,4-diamine
IUPAC Name: 5-methyl-6-pentylpyrido[2,3-d]pyrimidine-2,4-diamine
SYSTEMATIC NAME: 5-methyl-6-pentyl-pyrido[2,3-d]pyrimidine-2,4-diamine
MOLECULAR FORMULA: C13H19N5
MOLECULAR WEIGHT: 245.32346
SMILES: CCCCCC1=CN=C2C(=C1C)C(=NC(=N2)N)N
Structure:

CAS RN: 67466-13-1
CAS Name: 10-[3-(1-methyl-1-pyrrolidin-1-iumyl)propyl]pyrido[3,2-b][1,4]benzothiazine; methyl sulfate
OPENEYE Name: 10-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]pyrido[3,2-b][1,4]benzothiazine; methyl sulfate
IUPAC Name: 10-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]pyrido[3,2-b][1,4]benzothiazine; methyl sulfate
SYSTEMATIC NAME: 10-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]pyrido[3,2-b][1,4]benzothiazine; methyl sulfate
MOLECULAR FORMULA: C20H27N3O4S2
MOLECULAR WEIGHT: 437.57608
SMILES: C[N+]1(CCCC1)CCCN2C3=CC=CC=C3SC4=C2N=CC=C4.COS(=O)(=O)[O-]
Structure:

CAS RN: 67466-11-9
CAS Name: 10-[3-(1-pyrrolidinyl)propyl]pyrido[3,2-b][1,4]benzothiazine
OPENEYE Name: 10-(3-pyrrolidin-1-ylpropyl)pyrido[3,2-b][1,4]benzothiazine
IUPAC Name: 10-(3-pyrrolidin-1-ylpropyl)pyrido[3,2-b][1,4]benzothiazine
SYSTEMATIC NAME: 10-(3-pyrrolidin-1-ylpropyl)pyrido[3,2-b][1,4]benzothiazine
MOLECULAR FORMULA: C18H21N3S
MOLECULAR WEIGHT: 311.44444
SMILES: C1CCN(C1)CCCN2C3=CC=CC=C3SC4=C2N=CC=C4
Structure:

CAS RN: 67466-10-8
CAS Name: 10-[2-(1-pyrrolidinyl)propyl]pyrido[3,2-b][1,4]benzothiazine
OPENEYE Name: 10-(2-pyrrolidin-1-ylpropyl)pyrido[3,2-b][1,4]benzothiazine
IUPAC Name: 10-(2-pyrrolidin-1-ylpropyl)pyrido[3,2-b][1,4]benzothiazine
SYSTEMATIC NAME: 10-(2-pyrrolidin-1-ylpropyl)pyrido[3,2-b][1,4]benzothiazine
MOLECULAR FORMULA: C18H21N3S
MOLECULAR WEIGHT: 311.44444
SMILES: CC(CN1C2=CC=CC=C2SC3=C1N=CC=C3)N4CCCC4
Structure:

CAS RN: 67466-09-5
CAS Name: 10-[2-(1-pyrrolidinyl)ethyl]pyrido[3,2-b][1,4]benzothiazine
OPENEYE Name: 10-(2-pyrrolidin-1-ylethyl)pyrido[3,2-b][1,4]benzothiazine
IUPAC Name: 10-(2-pyrrolidin-1-ylethyl)pyrido[3,2-b][1,4]benzothiazine
SYSTEMATIC NAME: 10-(2-pyrrolidin-1-ylethyl)pyrido[3,2-b][1,4]benzothiazine
MOLECULAR FORMULA: C17H19N3S
MOLECULAR WEIGHT: 297.41786
SMILES: C1CCN(C1)CCN2C3=CC=CC=C3SC4=C2N=CC=C4
Structure:

CAS RN: 67466-08-4
CAS Name: 1-(3,4-dimethoxyphenyl)-2-hydroxy-2-methyl-1-propanone
OPENEYE Name: 1-(3,4-dimethoxyphenyl)-2-hydroxy-2-methyl-propan-1-one
IUPAC Name: 1-(3,4-dimethoxyphenyl)-2-hydroxy-2-methylpropan-1-one
SYSTEMATIC NAME: 1-(3,4-dimethoxyphenyl)-2-methyl-2-oxidanyl-propan-1-one
MOLECULAR FORMULA: C12H16O4
MOLECULAR WEIGHT: 224.25304
SMILES: CC(C)(C(=O)C1=CC(=C(C=C1)OC)OC)O
Structure:

CAS RN: 67466-07-3
CAS Name: 3-phenylpropanoic acid 3-(2-methyl-1-piperidinyl)propyl ester hydrochloride
OPENEYE Name: 3-(2-methyl-1-piperidyl)propyl 3-phenylpropanoate hydrochloride
IUPAC Name: 3-(2-methylpiperidin-1-yl)propyl 3-phenylpropanoate hydrochloride
SYSTEMATIC NAME: 3-(2-methylpiperidin-1-yl)propyl 3-phenylpropanoate hydrochloride
MOLECULAR FORMULA: C18H28ClNO2
MOLECULAR WEIGHT: 325.87342
SMILES: CC1CCCCN1CCCOC(=O)CCC2=CC=CC=C2.Cl
Structure:

CAS RN: 67466-06-2
CAS Name: 3-phenylpropanoic acid [2-(dimethylamino)-1-phenylethyl] ester
OPENEYE Name: [2-(dimethylamino)-1-phenyl-ethyl] 3-phenylpropanoate
IUPAC Name: [2-(dimethylamino)-1-phenylethyl] 3-phenylpropanoate
SYSTEMATIC NAME: [2-(dimethylamino)-1-phenyl-ethyl] 3-phenylpropanoate
MOLECULAR FORMULA: C19H23NO2
MOLECULAR WEIGHT: 297.39142
SMILES: CN(C)CC(C1=CC=CC=C1)OC(=O)CCC2=CC=CC=C2
Structure:

CAS RN: 67466-05-1
CAS Name: 3-hydroxy-2-phenylpropanoic acid 3-(1-piperidinyl)propyl ester
OPENEYE Name: 3-(1-piperidyl)propyl 3-hydroxy-2-phenyl-propanoate
IUPAC Name: 3-piperidin-1-ylpropyl 3-hydroxy-2-phenylpropanoate
SYSTEMATIC NAME: 3-piperidin-1-ylpropyl 3-oxidanyl-2-phenyl-propanoate
MOLECULAR FORMULA: C17H25NO3
MOLECULAR WEIGHT: 291.3853
SMILES: C1CCN(CC1)CCCOC(=O)C(CO)C2=CC=CC=C2
Structure:

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