Tuesday, August 2, 2011

http://ChemLookup.com Compounds




CAS RN: 6307-86-4
CAS Name: 1-(2-furanylmethylamino)-3-(2-methoxyphenyl)-2-propanol chloride
OPENEYE Name: 1-(2-furylmethylamino)-3-(2-methoxyphenyl)propan-2-ol chloride
IUPAC Name: 1-(furan-2-ylmethylamino)-3-(2-methoxyphenyl)propan-2-ol chloride
SYSTEMATIC NAME: 1-(furan-2-ylmethylamino)-3-(2-methoxyphenyl)propan-2-ol chloride
MOLECULAR FORMULA: C15H19ClNO3-
MOLECULAR WEIGHT: 296.76926
SMILES: COC1=CC=CC=C1CC(CNCC2=CC=CO2)O.[Cl-]
Structure:

CAS RN: 6307-84-2
CAS Name: 1-(2,5-dimethylphenyl)-3-(2-methylpropylamino)-2-propanol hydrochloride
OPENEYE Name: 1-(2,5-dimethylphenyl)-3-(isobutylamino)propan-2-ol hydrochloride
IUPAC Name: 1-(2,5-dimethylphenyl)-3-(2-methylpropylamino)propan-2-ol hydrochloride
SYSTEMATIC NAME: 1-(2,5-dimethylphenyl)-3-(2-methylpropylamino)propan-2-ol hydrochloride
MOLECULAR FORMULA: C15H26ClNO
MOLECULAR WEIGHT: 271.82604
SMILES: CC1=CC(=C(C=C1)C)CC(CNCC(C)C)O.Cl
Structure:

CAS RN: 6307-81-9
CAS Name: 3-(4-methyl-1-piperazinyl)propane-1,2-diol chloride
OPENEYE Name: 3-(4-methylpiperazin-1-yl)propane-1,2-diol chloride
IUPAC Name: 3-(4-methylpiperazin-1-yl)propane-1,2-diol chloride
SYSTEMATIC NAME: 3-(4-methylpiperazin-1-yl)propane-1,2-diol chloride
MOLECULAR FORMULA: C8H18ClN2O2-
MOLECULAR WEIGHT: 209.69372
SMILES: CN1CCN(CC1)CC(CO)O.[Cl-]
Structure:

CAS RN: 6307-80-8
CAS Name: N-(3-chlorophenyl)carbamic acid [2-[(3-chloroanilino)-oxomethoxy]-3-(dibutylamino)propyl] ester hydrochloride
OPENEYE Name: [2-[(3-chlorophenyl)carbamoyloxy]-3-(dibutylamino)propyl] N-(3-chlorophenyl)carbamate hydrochloride
IUPAC Name: [2-[(3-chlorophenyl)carbamoyloxy]-3-(dibutylamino)propyl] N-(3-chlorophenyl)carbamate hydrochloride
SYSTEMATIC NAME: [2-[(3-chlorophenyl)carbamoyloxy]-3-(dibutylamino)propyl] N-(3-chlorophenyl)carbamate hydrochloride
MOLECULAR FORMULA: C25H34Cl3N3O4
MOLECULAR WEIGHT: 546.91416
SMILES: CCCCN(CCCC)CC(COC(=O)NC1=CC(=CC=C1)Cl)OC(=O)NC2=CC(=CC=C2)Cl.Cl
Structure:

CAS RN: 6307-76-2
CAS Name: N-(3-chlorophenyl)carbamic acid [3-(dibutylamino)-2-hydroxypropyl] ester hydrochloride
OPENEYE Name: [3-(dibutylamino)-2-hydroxy-propyl] N-(3-chlorophenyl)carbamate hydrochloride
IUPAC Name: [3-(dibutylamino)-2-hydroxypropyl] N-(3-chlorophenyl)carbamate hydrochloride
SYSTEMATIC NAME: [3-(dibutylamino)-2-oxidanyl-propyl] N-(3-chlorophenyl)carbamate hydrochloride
MOLECULAR FORMULA: C18H30Cl2N2O3
MOLECULAR WEIGHT: 393.3484
SMILES: CCCCN(CCCC)CC(COC(=O)NC1=CC(=CC=C1)Cl)O.Cl
Structure:

CAS RN: 6307-65-9
CAS Name: [3-(aminomethyl)-2-bicyclo[2.2.2]octanyl]methanamine chloride
OPENEYE Name: [3-(aminomethyl)-2-bicyclo[2.2.2]octanyl]methanamine chloride
IUPAC Name: [3-(aminomethyl)-2-bicyclo[2.2.2]octanyl]methanamine chloride
SYSTEMATIC NAME: [3-(aminomethyl)-2-bicyclo[2.2.2]octanyl]methanamine chloride
MOLECULAR FORMULA: C10H20ClN2-
MOLECULAR WEIGHT: 203.7322
SMILES: C1CC2CCC1C(C2CN)CN.[Cl-]
Structure:

CAS RN: 18413-12-2
CAS Name: (carboxymethylthio)-[3-[[(3-carboxy-1,2,2-trimethylcyclopentyl)-oxomethyl]amino]-2-methoxypropyl]mercury; sodium
OPENEYE Name: carboxymethylsulfanyl-[3-[(3-carboxy-1,2,2-trimethyl-cyclopentanecarbonyl)amino]-2-methoxy-propyl]mercury; sodium
IUPAC Name: carboxymethylsulfanyl-[3-[(3-carboxy-1,2,2-trimethylcyclopentanecarbonyl)amino]-2-methoxypropyl]mercury; sodium
SYSTEMATIC NAME: [3-[(3-carboxy-1,2,2-trimethyl-cyclopentyl)carbonylamino]-2-methoxy-propyl]-(2-hydroxy-2-oxoethylsulfanyl)mercury; sodium
MOLECULAR FORMULA: C16H27HgNNaO6S
MOLECULAR WEIGHT: 585.03345
SMILES: CC1(C(CCC1(C)C(=O)NCC(C[Hg]SCC(=O)O)OC)C(=O)O)C.[Na]
Structure:

CAS RN: 7248-32-0
CAS Name: N,N-diethyl-2-(8-methyl-9-propyl-7,9-dihydro-6H-[1,3]dioxolo[4,5-h]isoquinolin-8-ium-8-yl)ethanamine iodide
OPENEYE Name: N,N-diethyl-2-(8-methyl-9-propyl-7,9-dihydro-6H-[1,3]dioxolo[4,5-h]isoquinolin-8-ium-8-yl)ethanamine iodide
IUPAC Name: N,N-diethyl-2-(8-methyl-9-propyl-7,9-dihydro-6H-[1,3]dioxolo[4,5-h]isoquinolin-8-ium-8-yl)ethanamine iodide
SYSTEMATIC NAME: N,N-diethyl-2-(8-methyl-9-propyl-7,9-dihydro-6H-[1,3]dioxolo[4,5-h]isoquinolin-8-ium-8-yl)ethanamine iodide
MOLECULAR FORMULA: C20H33IN2O2
MOLECULAR WEIGHT: 460.39269
SMILES: CCCC1C2=C(CC[N+]1(C)CCN(CC)CC)C=CC3=C2OCO3.[I-]
Structure:

CAS RN: 6301-13-9
CAS Name: 3-(1,3-benzodioxol-5-yl)-1-propanamine hydrochloride
OPENEYE Name: 3-(1,3-benzodioxol-5-yl)propan-1-amine hydrochloride
IUPAC Name: 3-(1,3-benzodioxol-5-yl)propan-1-amine hydrochloride
SYSTEMATIC NAME: 3-(1,3-benzodioxol-5-yl)propan-1-amine hydrochloride
MOLECULAR FORMULA: C10H14ClNO2
MOLECULAR WEIGHT: 215.67666
SMILES: C1OC2=C(O1)C=C(C=C2)CCCN.Cl
Structure:

CAS RN: 6328-93-4
CAS Name: 1-phenyl-4-piperidinone chloride
OPENEYE Name: 1-phenylpiperidin-4-one chloride
IUPAC Name: 1-phenylpiperidin-4-one chloride
SYSTEMATIC NAME: 1-phenylpiperidin-4-one chloride
MOLECULAR FORMULA: C11H13ClNO-
MOLECULAR WEIGHT: 210.68002
SMILES: C1CN(CCC1=O)C2=CC=CC=C2.[Cl-]
Structure:

CAS RN: 6311-05-3
CAS Name: 4-[(5-nitro-2-pyridinyl)azo]-3-[(5-nitro-2-pyridinyl)hydrazo]-1-naphthalenesulfonic acid; sodium
OPENEYE Name: 4-[(5-nitro-2-pyridyl)azo]-3-[2-(5-nitro-2-pyridyl)hydrazino]naphthalene-1-sulfonic acid; sodium
IUPAC Name: 4-[(5-nitropyridin-2-yl)diazenyl]-3-[2-(5-nitropyridin-2-yl)hydrazinyl]naphthalene-1-sulfonic acid; sodium
SYSTEMATIC NAME: 4-[(5-nitropyridin-2-yl)diazenyl]-3-[2-(5-nitropyridin-2-yl)hydrazinyl]naphthalene-1-sulfonic acid; sodium
MOLECULAR FORMULA: C20H14N8NaO7S
MOLECULAR WEIGHT: 533.42933
SMILES: C1=CC=C2C(=C1)C(=CC(=C2N=NC3=NC=C(C=C3)[N+](=O)[O-])NNC4=NC=C(C=C4)[N+](=O)[O-])S(=O)(=O)O.[Na]
Structure:

CAS RN: 6936-80-7
CAS Name: (2Z)-2-[(5-nitro-2-pyridinyl)hydrazinylidene]propanoic acid; sodium
OPENEYE Name: (2Z)-2-[(5-nitro-2-pyridyl)hydrazono]propanoic acid; sodium
IUPAC Name: (2Z)-2-[(5-nitropyridin-2-yl)hydrazinylidene]propanoic acid; sodium
SYSTEMATIC NAME: (2Z)-2-[(5-nitropyridin-2-yl)hydrazinylidene]propanoic acid; sodium
MOLECULAR FORMULA: C8H8N4NaO4
MOLECULAR WEIGHT: 247.16329
SMILES: C/C(=N/NC1=NC=C(C=C1)[N+](=O)[O-])/C(=O)O.[Na]
Structure:

CAS RN: 17121-89-0
CAS Name: sodium; 2H-1,2,4-triazine-3,5-dione
OPENEYE Name: sodium; 2H-1,2,4-triazine-3,5-dione
IUPAC Name: sodium; 2H-1,2,4-triazine-3,5-dione
SYSTEMATIC NAME: sodium; 2H-1,2,4-triazine-3,5-dione
MOLECULAR FORMULA: C3H3N3NaO2
MOLECULAR WEIGHT: 136.06459
SMILES: C1=NNC(=O)NC1=O.[Na]
Structure:

CAS RN: 6310-58-3
CAS Name: 2-[bis[4-(dimethylamino)phenyl]methyl]benzoic acid; sodium
OPENEYE Name: 2-[bis[4-(dimethylamino)phenyl]methyl]benzoic acid; sodium
IUPAC Name: 2-[bis[4-(dimethylamino)phenyl]methyl]benzoic acid; sodium
SYSTEMATIC NAME: 2-[bis[4-(dimethylamino)phenyl]methyl]benzoic acid; sodium
MOLECULAR FORMULA: C24H26N2NaO2
MOLECULAR WEIGHT: 397.46521
SMILES: CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=CC=CC=C3C(=O)O.[Na]
Structure:

CAS RN: 6310-48-1
CAS Name: 2-[bis[4-(dimethylamino)phenyl]methyl]benzenesulfonic acid; sodium
OPENEYE Name: 2-[bis[4-(dimethylamino)phenyl]methyl]benzenesulfonic acid; sodium
IUPAC Name: 2-[bis[4-(dimethylamino)phenyl]methyl]benzenesulfonic acid; sodium
SYSTEMATIC NAME: 2-[bis[4-(dimethylamino)phenyl]methyl]benzenesulfonic acid; sodium
MOLECULAR FORMULA: C23H26N2NaO3S
MOLECULAR WEIGHT: 433.51891
SMILES: CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=CC=CC=C3S(=O)(=O)O.[Na]
Structure:

CAS RN: 7154-08-7
CAS Name: 2-methylpropanoic acid 2-[bis(2-phenylethyl)amino]ethyl ester chloride
OPENEYE Name: 2-[bis(2-phenylethyl)amino]ethyl 2-methylpropanoate chloride
IUPAC Name: 2-[bis(2-phenylethyl)amino]ethyl 2-methylpropanoate chloride
SYSTEMATIC NAME: 2-[bis(2-phenylethyl)amino]ethyl 2-methylpropanoate chloride
MOLECULAR FORMULA: C22H29ClNO2-
MOLECULAR WEIGHT: 374.92416
SMILES: CC(C)C(=O)OCCN(CCC1=CC=CC=C1)CCC2=CC=CC=C2.[Cl-]
Structure:

CAS RN: 7154-07-6
CAS Name: acetic acid 2-[bis(2-phenylethyl)amino]ethyl ester chloride
OPENEYE Name: 2-[bis(2-phenylethyl)amino]ethyl acetate chloride
IUPAC Name: 2-[bis(2-phenylethyl)amino]ethyl acetate chloride
SYSTEMATIC NAME: 2-[bis(2-phenylethyl)amino]ethyl ethanoate chloride
MOLECULAR FORMULA: C20H25ClNO2-
MOLECULAR WEIGHT: 346.871
SMILES: CC(=O)OCCN(CCC1=CC=CC=C1)CCC2=CC=CC=C2.[Cl-]
Structure:

CAS RN: 7154-06-5
CAS Name: 2-[bis(2-phenylethyl)amino]ethanol chloride
OPENEYE Name: 2-[bis(2-phenylethyl)amino]ethanol chloride
IUPAC Name: 2-[bis(2-phenylethyl)amino]ethanol chloride
SYSTEMATIC NAME: 2-[bis(2-phenylethyl)amino]ethanol chloride
MOLECULAR FORMULA: C18H23ClNO-
MOLECULAR WEIGHT: 304.83432
SMILES: C1=CC=C(C=C1)CCN(CCC2=CC=CC=C2)CCO.[Cl-]
Structure:

CAS RN: 6301-45-7
CAS Name: 2-methylpropanoic acid 2-[methyl(2-phenylethyl)amino]ethyl ester chloride
OPENEYE Name: 2-[methyl(2-phenylethyl)amino]ethyl 2-methylpropanoate chloride
IUPAC Name: 2-[methyl(2-phenylethyl)amino]ethyl 2-methylpropanoate chloride
SYSTEMATIC NAME: 2-[methyl(2-phenylethyl)amino]ethyl 2-methylpropanoate chloride
MOLECULAR FORMULA: C15H23ClNO2-
MOLECULAR WEIGHT: 284.80162
SMILES: CC(C)C(=O)OCCN(C)CCC1=CC=CC=C1.[Cl-]
Structure:

CAS RN: 6301-44-6
CAS Name: 2-[methyl(2-phenylethyl)amino]ethanol bromide
OPENEYE Name: 2-[methyl(2-phenylethyl)amino]ethanol bromide
IUPAC Name: 2-[methyl(2-phenylethyl)amino]ethanol bromide
SYSTEMATIC NAME: 2-[methyl(2-phenylethyl)amino]ethanol bromide
MOLECULAR FORMULA: C11H17BrNO-
MOLECULAR WEIGHT: 259.16278
SMILES: CN(CCC1=CC=CC=C1)CCO.[Br-]
Structure:

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