Monday, August 1, 2011

http://ChemLookup.com Compounds




CAS RN: 92961-77-8
CAS Name: (2-chlorophenyl)-[2-[(dimethylamino)methyl]phenyl]methanol bromide
OPENEYE Name: (2-chlorophenyl)-[2-[(dimethylamino)methyl]phenyl]methanol bromide
IUPAC Name: (2-chlorophenyl)-[2-[(dimethylamino)methyl]phenyl]methanol bromide
SYSTEMATIC NAME: (2-chlorophenyl)-[2-[(dimethylamino)methyl]phenyl]methanol bromide
MOLECULAR FORMULA: C16H18BrClNO-
MOLECULAR WEIGHT: 355.67722
SMILES: CN(C)CC1=CC=CC=C1C(C2=CC=CC=C2Cl)O.[Br-]
Structure:

CAS RN: 6960-41-4
CAS Name: 2-hydroxy-4-[2-hydroxyethyl(methyl)amino]benzoic acid chloride
OPENEYE Name: 2-hydroxy-4-[2-hydroxyethyl(methyl)amino]benzoic acid chloride
IUPAC Name: 2-hydroxy-4-[2-hydroxyethyl(methyl)amino]benzoic acid chloride
SYSTEMATIC NAME: 4-[2-hydroxyethyl(methyl)amino]-2-oxidanyl-benzoic acid chloride
MOLECULAR FORMULA: C10H13ClNO4-
MOLECULAR WEIGHT: 246.66752
SMILES: CN(CCO)C1=CC(=C(C=C1)C(=O)O)O.[Cl-]
Structure:

CAS RN: 6960-06-1
CAS Name: 2-(1,4-oxathian-4-ium-4-yl)propanoic acid bromide
OPENEYE Name: 2-(1,4-oxathian-4-ium-4-yl)propanoic acid bromide
IUPAC Name: 2-(1,4-oxathian-4-ium-4-yl)propanoic acid bromide
SYSTEMATIC NAME: 2-(1,4-oxathian-4-ium-4-yl)propanoic acid bromide
MOLECULAR FORMULA: C7H13BrO3S
MOLECULAR WEIGHT: 257.14532
SMILES: CC(C(=O)O)[S+]1CCOCC1.[Br-]
Structure:

CAS RN: 6959-99-5
CAS Name: 5-[bis[[(2,5-dioxo-1-pyrrolyl)-oxomethyl]amino]methyl]-2-hydroxy-3-methoxybenzenesulfonic acid; sodium
OPENEYE Name: 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid; sodium
IUPAC Name: 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxybenzenesulfonic acid; sodium
SYSTEMATIC NAME: 5-[bis[[2,5-bis(oxidanylidene)pyrrol-1-yl]carbonylamino]methyl]-3-methoxy-2-oxidanyl-benzenesulfonic acid; sodium
MOLECULAR FORMULA: C18H14N4NaO11S
MOLECULAR WEIGHT: 517.37873
SMILES: COC1=C(C(=CC(=C1)C(NC(=O)N2C(=O)C=CC2=O)NC(=O)N3C(=O)C=CC3=O)S(=O)(=O)O)O.[Na]
Structure:

CAS RN: 7252-48-4
CAS Name: 6-chloro-5-(methylamino)-1H-pyrimidin-4-one hydrochloride
OPENEYE Name: 6-chloro-5-(methylamino)-1H-pyrimidin-4-one hydrochloride
IUPAC Name: 6-chloro-5-(methylamino)-1H-pyrimidin-4-one hydrochloride
SYSTEMATIC NAME: 6-chloranyl-5-(methylamino)-1H-pyrimidin-4-one hydrochloride
MOLECULAR FORMULA: C5H7Cl2N3O
MOLECULAR WEIGHT: 196.03458
SMILES: CNC1=C(NC=NC1=O)Cl.Cl
Structure:

CAS RN: 1934-07-2
CAS Name: N,N-dimethyl-N'-phenylmethanimidamide chloride
OPENEYE Name: N,N-dimethyl-N'-phenyl-formamidine chloride
IUPAC Name: N,N-dimethyl-N'-phenylmethanimidamide chloride
SYSTEMATIC NAME: N,N-dimethyl-N'-phenyl-methanimidamide chloride
MOLECULAR FORMULA: C9H12ClN2-
MOLECULAR WEIGHT: 183.65798
SMILES: CN(C)C=NC1=CC=CC=C1.[Cl-]
Structure:

CAS RN: 2168-24-3
CAS Name: N'-(3-chlorophenyl)-N,N-dimethylmethanimidamide hydrochloride
OPENEYE Name: N'-(3-chlorophenyl)-N,N-dimethyl-formamidine hydrochloride
IUPAC Name: N'-(3-chlorophenyl)-N,N-dimethylmethanimidamide hydrochloride
SYSTEMATIC NAME: N'-(3-chlorophenyl)-N,N-dimethyl-methanimidamide hydrochloride
MOLECULAR FORMULA: C9H12Cl2N2
MOLECULAR WEIGHT: 219.11098
SMILES: CN(C)C=NC1=CC(=CC=C1)Cl.Cl
Structure:

CAS RN: 6959-75-7
CAS Name: 2-(hydroxymethyl)-4-(2-mercaptoethylamino)-6-methoxyoxane-3,5-diol chloride
OPENEYE Name: 2-(hydroxymethyl)-6-methoxy-4-(2-sulfanylethylamino)tetrahydropyran-3,5-diol chloride
IUPAC Name: 2-(hydroxymethyl)-6-methoxy-4-(2-sulfanylethylamino)oxane-3,5-diol chloride
SYSTEMATIC NAME: 2-(hydroxymethyl)-6-methoxy-4-(2-sulfanylethylamino)oxane-3,5-diol chloride
MOLECULAR FORMULA: C9H19ClNO5S-
MOLECULAR WEIGHT: 288.76886
SMILES: COC1C(C(C(C(O1)CO)O)NCCS)O.[Cl-]
Structure:

CAS RN: 10469-70-2
CAS Name: [(Z)-1-aminopropan-2-ylideneamino]urea chloride
OPENEYE Name: [(Z)-(2-amino-1-methyl-ethylidene)amino]urea chloride
IUPAC Name: [(Z)-1-aminopropan-2-ylideneamino]urea chloride
SYSTEMATIC NAME: 1-[(Z)-1-azanylpropan-2-ylideneamino]urea chloride
MOLECULAR FORMULA: C4H10ClN4O-
MOLECULAR WEIGHT: 165.6014
SMILES: C/C(=N/NC(=O)N)/CN.[Cl-]
Structure:

CAS RN: 27930-62-7
CAS Name: 1-[4-[[[4-[(3-methoxypropylamino)-methyliminomethyl]anilino]-oxomethyl]amino]phenyl]-3-[4-[(3-methoxypropylamino)-methyliminomethyl]phenyl]urea chloride
OPENEYE Name: 1-[4-[N-(3-methoxypropyl)-N'-methyl-carbamimidoyl]phenyl]-3-[4-[[4-[N-(3-methoxypropyl)-N'-methyl-carbamimidoyl]phenyl]carbamoylamino]phenyl]urea chloride
IUPAC Name: 1-[4-[N-(3-methoxypropyl)-N'-methylcarbamimidoyl]phenyl]-3-[4-[[4-[N-(3-methoxypropyl)-N'-methylcarbamimidoyl]phenyl]carbamoylamino]phenyl]urea chloride
SYSTEMATIC NAME: 1-[4-[N-(3-methoxypropyl)-N'-methyl-carbamimidoyl]phenyl]-3-[4-[[4-[N-(3-methoxypropyl)-N'-methyl-carbamimidoyl]phenyl]carbamoylamino]phenyl]urea chloride
MOLECULAR FORMULA: C32H42ClN8O4-
MOLECULAR WEIGHT: 638.18008
SMILES: CN=C(C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)C(=NC)NCCCOC)NCCCOC.[Cl-]
Structure:

CAS RN: 21692-40-0
CAS Name: 2-chloro-N1,N4-bis[4-[diethylamino(ethylimino)methyl]phenyl]benzene-1,4-dicarboxamide hydrochloride
OPENEYE Name: 2-chloro-N1,N4-bis[4-(N,N,N'-triethylcarbamimidoyl)phenyl]terephthalamide hydrochloride
IUPAC Name: 2-chloro-1-N,4-N-bis[4-(N,N,N'-triethylcarbamimidoyl)phenyl]benzene-1,4-dicarboxamide hydrochloride
SYSTEMATIC NAME: 2-chloranyl-N1,N4-bis[4-(N,N,N'-triethylcarbamimidoyl)phenyl]benzene-1,4-dicarboxamide hydrochloride
MOLECULAR FORMULA: C34H44Cl2N6O2
MOLECULAR WEIGHT: 639.65816
SMILES: CCN=C(C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=NCC)N(CC)CC)Cl)N(CC)CC.Cl
Structure:

CAS RN: 21696-34-4
CAS Name: 2-chloro-N1,N4-bis[4-[ethylamino(ethylimino)methyl]phenyl]benzene-1,4-dicarboxamide hydrochloride
OPENEYE Name: 2-chloro-N1,N4-bis[4-(N,N'-diethylcarbamimidoyl)phenyl]terephthalamide hydrochloride
IUPAC Name: 2-chloro-1-N,4-N-bis[4-(N,N'-diethylcarbamimidoyl)phenyl]benzene-1,4-dicarboxamide hydrochloride
SYSTEMATIC NAME: 2-chloranyl-N1,N4-bis[4-(N,N'-diethylcarbamimidoyl)phenyl]benzene-1,4-dicarboxamide hydrochloride
MOLECULAR FORMULA: C30H36Cl2N6O2
MOLECULAR WEIGHT: 583.55184
SMILES: CCNC(=NCC)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=NCC)NCC)Cl.Cl
Structure:

CAS RN: 21696-33-3
CAS Name: 5-amino-N1,N3-bis[4-[dimethylamino(methylimino)methyl]phenyl]benzene-1,3-dicarboxamide chloride
OPENEYE Name: 5-amino-N1,N3-bis[4-(N,N,N'-trimethylcarbamimidoyl)phenyl]benzene-1,3-dicarboxamide chloride
IUPAC Name: 5-amino-1-N,3-N-bis[4-(N,N,N'-trimethylcarbamimidoyl)phenyl]benzene-1,3-dicarboxamide chloride
SYSTEMATIC NAME: 5-azanyl-N1,N3-bis[4-(N,N,N'-trimethylcarbamimidoyl)phenyl]benzene-1,3-dicarboxamide chloride
MOLECULAR FORMULA: C28H33ClN7O2-
MOLECULAR WEIGHT: 535.06032
SMILES: CN=C(C1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)N)C(=O)NC3=CC=C(C=C3)C(=NC)N(C)C)N(C)C.[Cl-]
Structure:

CAS RN: 10471-79-1
CAS Name: 4-[(7-chloro-3-cyclopentyl-2-methyl-4-quinolinyl)amino]-2-(diethylaminomethyl)phenol hydrochloride
OPENEYE Name: 4-[(7-chloro-3-cyclopentyl-2-methyl-4-quinolyl)amino]-2-(diethylaminomethyl)phenol hydrochloride
IUPAC Name: 4-[(7-chloro-3-cyclopentyl-2-methylquinolin-4-yl)amino]-2-(diethylaminomethyl)phenol hydrochloride
SYSTEMATIC NAME: 4-[(7-chloranyl-3-cyclopentyl-2-methyl-quinolin-4-yl)amino]-2-(diethylaminomethyl)phenol hydrochloride
MOLECULAR FORMULA: C26H33Cl2N3O
MOLECULAR WEIGHT: 474.46572
SMILES: CCN(CC)CC1=C(C=CC(=C1)NC2=C(C(=NC3=C2C=CC(=C3)Cl)C)C4CCCC4)O.Cl
Structure:

CAS RN: 7069-34-3
CAS Name: 3-[(Z)-[(1E)-1-[[dimethylamino(methylimino)methyl]hydrazinylidene]propan-2-ylidene]amino]-1,1,2-trimethylguanidine hydroiodide
OPENEYE Name: 1,1,2-trimethyl-3-[(Z)-[(2E)-1-methyl-2-[(N,N,N'-trimethylcarbamimidoyl)hydrazono]ethylidene]amino]guanidine hydroiodide
IUPAC Name: 1,1,2-trimethyl-3-[(Z)-[(1E)-1-[(N,N,N'-trimethylcarbamimidoyl)hydrazinylidene]propan-2-ylidene]amino]guanidine hydroiodide
SYSTEMATIC NAME: 1,1,2-trimethyl-3-[(Z)-[(1E)-1-[(N,N,N'-trimethylcarbamimidoyl)hydrazinylidene]propan-2-ylidene]amino]guanidine hydroiodide
MOLECULAR FORMULA: C11H25IN8
MOLECULAR WEIGHT: 396.27427
SMILES: C/C(=N/NC(=NC)N(C)C)/C=N/NC(=NC)N(C)C.I
Structure:

CAS RN: 6969-99-9
CAS Name: [2-[hydroxy(phenyl)methyl]phenyl]methyl-dimethyl-(phenylmethyl)ammonium bromide
OPENEYE Name: benzyl-[[2-[hydroxy(phenyl)methyl]phenyl]methyl]-dimethyl-ammonium bromide
IUPAC Name: benzyl-[[2-[hydroxy(phenyl)methyl]phenyl]methyl]-dimethylazanium bromide
SYSTEMATIC NAME: dimethyl-[[2-[oxidanyl(phenyl)methyl]phenyl]methyl]-(phenylmethyl)azanium bromide
MOLECULAR FORMULA: C23H26BrNO
MOLECULAR WEIGHT: 412.36264
SMILES: C[N+](C)(CC1=CC=CC=C1)CC2=CC=CC=C2C(C3=CC=CC=C3)O.[Br-]
Structure:

CAS RN: 93636-74-9
CAS Name: (Z)-N,N,N',N'-tetramethyl-2-butene-1,4-diamine chloride
OPENEYE Name: (Z)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine chloride
IUPAC Name: (Z)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine chloride
SYSTEMATIC NAME: (Z)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine chloride
MOLECULAR FORMULA: C8H18ClN2-
MOLECULAR WEIGHT: 177.69492
SMILES: CN(C)C/C=C\CN(C)C.[Cl-]
Structure:

CAS RN: 2677-00-1
CAS Name: 1-phenyl-N-(2,2,2-trifluoroethyl)-2-propanamine chloride
OPENEYE Name: 1-phenyl-N-(2,2,2-trifluoroethyl)propan-2-amine chloride
IUPAC Name: 1-phenyl-N-(2,2,2-trifluoroethyl)propan-2-amine chloride
SYSTEMATIC NAME: 1-phenyl-N-[2,2,2-tris(fluoranyl)ethyl]propan-2-amine chloride
MOLECULAR FORMULA: C11H14ClF3N-
MOLECULAR WEIGHT: 252.68377
SMILES: CC(CC1=CC=CC=C1)NCC(F)(F)F.[Cl-]
Structure:

CAS RN: 93532-08-2
CAS Name: N,N-bis(2-chloroethyl)-3-cyclopentyl-1-propanamine hydrochloride
OPENEYE Name: N,N-bis(2-chloroethyl)-3-cyclopentyl-propan-1-amine hydrochloride
IUPAC Name: N,N-bis(2-chloroethyl)-3-cyclopentylpropan-1-amine hydrochloride
SYSTEMATIC NAME: N,N-bis(2-chloroethyl)-3-cyclopentyl-propan-1-amine hydrochloride
MOLECULAR FORMULA: C12H24Cl3N
MOLECULAR WEIGHT: 288.68466
SMILES: C1CCC(C1)CCCN(CCCl)CCCl.Cl
Structure:

CAS RN: 92400-42-5
CAS Name: 2-[2-(dimethylamino)ethylsulfonylthio]-N,N-dimethylethanamine hydrochloride
OPENEYE Name: 2-[2-(dimethylamino)ethylsulfonylsulfanyl]-N,N-dimethyl-ethanamine hydrochloride
IUPAC Name: 2-[2-(dimethylamino)ethylsulfonylsulfanyl]-N,N-dimethylethanamine hydrochloride
SYSTEMATIC NAME: 2-[2-(dimethylamino)ethylsulfonylsulfanyl]-N,N-dimethyl-ethanamine hydrochloride
MOLECULAR FORMULA: C8H21ClN2O2S2
MOLECULAR WEIGHT: 276.84754
SMILES: CN(C)CCSS(=O)(=O)CCN(C)C.Cl
Structure:

CAS RN: 82364-54-3
CAS Name: 1-(diethylaminomethyl)-2-naphthalenol chloride
OPENEYE Name: 1-(diethylaminomethyl)naphthalen-2-ol chloride
IUPAC Name: 1-(diethylaminomethyl)naphthalen-2-ol chloride
SYSTEMATIC NAME: 1-(diethylaminomethyl)naphthalen-2-ol chloride
MOLECULAR FORMULA: C15H19ClNO-
MOLECULAR WEIGHT: 264.77046
SMILES: CCN(CC)CC1=C(C=CC2=CC=CC=C21)O.[Cl-]
Structure:

CAS RN: 6969-62-6
CAS Name: 4-amino-2-(4-morpholinylmethyl)phenol chloride
OPENEYE Name: 4-amino-2-(morpholinomethyl)phenol chloride
IUPAC Name: 4-amino-2-(morpholin-4-ylmethyl)phenol chloride
SYSTEMATIC NAME: 4-azanyl-2-(morpholin-4-ylmethyl)phenol chloride
MOLECULAR FORMULA: C11H16ClN2O2-
MOLECULAR WEIGHT: 243.70994
SMILES: C1COCCN1CC2=C(C=CC(=C2)N)O.[Cl-]
Structure:

CAS RN: 63759-97-7
CAS Name: 2-[(2-hydroxyanilino)methyl]phenol chloride
OPENEYE Name: 2-[(2-hydroxyanilino)methyl]phenol chloride
IUPAC Name: 2-[(2-hydroxyanilino)methyl]phenol chloride
SYSTEMATIC NAME: 2-[[(2-hydroxyphenyl)amino]methyl]phenol chloride
MOLECULAR FORMULA: C13H13ClNO2-
MOLECULAR WEIGHT: 250.70082
SMILES: C1=CC=C(C(=C1)CNC2=CC=CC=C2O)O.[Cl-]
Structure:

CAS RN: 91562-00-4
CAS Name: 2-chloro-N-(2-chloroethyl)-N-[(4-methoxyphenyl)methyl]ethanamine hydrochloride
OPENEYE Name: 2-chloro-N-(2-chloroethyl)-N-[(4-methoxyphenyl)methyl]ethanamine hydrochloride
IUPAC Name: 2-chloro-N-(2-chloroethyl)-N-[(4-methoxyphenyl)methyl]ethanamine hydrochloride
SYSTEMATIC NAME: 2-chloranyl-N-(2-chloroethyl)-N-[(4-methoxyphenyl)methyl]ethanamine hydrochloride
MOLECULAR FORMULA: C12H18Cl3NO
MOLECULAR WEIGHT: 298.63642
SMILES: COC1=CC=C(C=C1)CN(CCCl)CCCl.Cl
Structure:

CAS RN: 6969-48-8
CAS Name: N-[2-(diethylamino)ethyl]-2-prop-2-enoxybenzamide chloride
OPENEYE Name: 2-allyloxy-N-[2-(diethylamino)ethyl]benzamide chloride
IUPAC Name: N-[2-(diethylamino)ethyl]-2-prop-2-enoxybenzamide chloride
SYSTEMATIC NAME: N-[2-(diethylamino)ethyl]-2-prop-2-enoxy-benzamide chloride
MOLECULAR FORMULA: C16H24ClN2O2-
MOLECULAR WEIGHT: 311.82696
SMILES: CCN(CC)CCNC(=O)C1=CC=CC=C1OCC=C.[Cl-]
Structure:

CAS RN: 6967-51-7
CAS Name: (3,4-dimethoxyphenyl)methanamine chloride
OPENEYE Name: (3,4-dimethoxyphenyl)methanamine chloride
IUPAC Name: (3,4-dimethoxyphenyl)methanamine chloride
SYSTEMATIC NAME: (3,4-dimethoxyphenyl)methanamine chloride
MOLECULAR FORMULA: C9H13ClNO2-
MOLECULAR WEIGHT: 202.65802
SMILES: COC1=C(C=C(C=C1)CN)OC.[Cl-]
Structure:

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