Monday, January 23, 2012

http://ChemLookup.com Compounds




CAS RN: 132993-98-7
CAS Name: 2-benzofuranyl-[4-[(dimethylamino)methyl]-5-hydroxy-2-methyl-3-benzofuranyl]methanone hydrochloride
OPENEYE Name: benzofuran-2-yl-[4-[(dimethylamino)methyl]-5-hydroxy-2-methyl-benzofuran-3-yl]methanone hydrochloride
IUPAC Name: 1-benzofuran-2-yl-[4-[(dimethylamino)methyl]-5-hydroxy-2-methyl-1-benzofuran-3-yl]methanone hydrochloride
SYSTEMATIC NAME: 1-benzofuran-2-yl-[4-[(dimethylamino)methyl]-2-methyl-5-oxidanyl-1-benzofuran-3-yl]methanone hydrochloride
MOLECULAR FORMULA: C21H20ClNO4
MOLECULAR WEIGHT: 385.8408
SMILES: CC1=C(C2=C(O1)C=CC(=C2CN(C)C)O)C(=O)C3=CC4=CC=CC=C4O3.Cl
Structure:

CAS RN: 132993-96-5
CAS Name: 2-(1-imidazolyl)-1-(5-methoxy-2-methyl-3-benzofuranyl)ethanone
OPENEYE Name: 2-imidazol-1-yl-1-(5-methoxy-2-methyl-benzofuran-3-yl)ethanone
IUPAC Name: 2-imidazol-1-yl-1-(5-methoxy-2-methyl-1-benzofuran-3-yl)ethanone
SYSTEMATIC NAME: 2-imidazol-1-yl-1-(5-methoxy-2-methyl-1-benzofuran-3-yl)ethanone
MOLECULAR FORMULA: C15H14N2O3
MOLECULAR WEIGHT: 270.28326
SMILES: CC1=C(C2=C(O1)C=CC(=C2)OC)C(=O)CN3C=CN=C3
Structure:

CAS RN: 132993-95-4
CAS Name: (4,5-diphenyl-2-thiophenyl)-(5-methoxy-2-methyl-3-benzofuranyl)methanone
OPENEYE Name: (4,5-diphenyl-2-thienyl)-(5-methoxy-2-methyl-benzofuran-3-yl)methanone
IUPAC Name: (4,5-diphenylthiophen-2-yl)-(5-methoxy-2-methyl-1-benzofuran-3-yl)methanone
SYSTEMATIC NAME: (4,5-diphenylthiophen-2-yl)-(5-methoxy-2-methyl-1-benzofuran-3-yl)methanone
MOLECULAR FORMULA: C27H20O3S
MOLECULAR WEIGHT: 424.5109
SMILES: CC1=C(C2=C(O1)C=CC(=C2)OC)C(=O)C3=CC(=C(S3)C4=CC=CC=C4)C5=CC=CC=C5
Structure:

CAS RN: 132953-12-9
CAS Name: 2-(1-methyl-4-piperidinyl)-3-(phenylmethyl)imidazo[4,5-b]pyridine
OPENEYE Name: 3-benzyl-2-(1-methyl-4-piperidyl)imidazo[4,5-b]pyridine
IUPAC Name: 3-benzyl-2-(1-methylpiperidin-4-yl)imidazo[4,5-b]pyridine
SYSTEMATIC NAME: 2-(1-methylpiperidin-4-yl)-3-(phenylmethyl)imidazo[4,5-b]pyridine
MOLECULAR FORMULA: C19H22N4
MOLECULAR WEIGHT: 306.40478
SMILES: CN1CCC(CC1)C2=NC3=C(N2CC4=CC=CC=C4)N=CC=C3
Structure:

CAS RN: 132901-24-7
CAS Name: 5-fluoro-2-[6-(5-fluoro-6-oxo-1H-pyrimidin-2-yl)hexyl]-1H-pyrimidin-6-one
OPENEYE Name: 5-fluoro-2-[6-(5-fluoro-6-oxo-1H-pyrimidin-2-yl)hexyl]-1H-pyrimidin-6-one
IUPAC Name: 5-fluoro-2-[6-(5-fluoro-6-oxo-1H-pyrimidin-2-yl)hexyl]-1H-pyrimidin-6-one
SYSTEMATIC NAME: 5-fluoranyl-2-[6-(5-fluoranyl-6-oxidanylidene-1H-pyrimidin-2-yl)hexyl]-1H-pyrimidin-6-one
MOLECULAR FORMULA: C14H16F2N4O2
MOLECULAR WEIGHT: 310.299246
SMILES: C1=C(C(=O)NC(=N1)CCCCCCC2=NC=C(C(=O)N2)F)F
Structure:

CAS RN: 132901-23-6
CAS Name: 2-[(4-bromophenyl)methyl]-5-fluoro-1H-pyrimidin-6-one
OPENEYE Name: 2-[(4-bromophenyl)methyl]-5-fluoro-1H-pyrimidin-6-one
IUPAC Name: 2-[(4-bromophenyl)methyl]-5-fluoro-1H-pyrimidin-6-one
SYSTEMATIC NAME: 2-[(4-bromophenyl)methyl]-5-fluoranyl-1H-pyrimidin-6-one
MOLECULAR FORMULA: C11H8BrFN2O
MOLECULAR WEIGHT: 283.096423
SMILES: C1=CC(=CC=C1CC2=NC=C(C(=O)N2)F)Br
Structure:

CAS RN: 132829-10-8
CAS Name: ammonia; cobalt(2+); 2-oxopentanedioate
OPENEYE Name: cobaltous; ammonia; 2-oxopentanedioate
IUPAC Name: azane; cobalt(2+); 2-oxopentanedioate
SYSTEMATIC NAME: azane; cobalt(2+); 2-oxidanylidenepentanedioate
MOLECULAR FORMULA: C5H13CoN3O5
MOLECULAR WEIGHT: 254.10702
SMILES: C(CC(=O)[O-])C(=O)C(=O)[O-].N.N.N.[Co+2]
Structure:

CAS RN: 132767-55-6
CAS Name: 1-(4-piperidinyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
OPENEYE Name: 1-(4-piperidyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
IUPAC Name: 1-piperidin-4-yl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
SYSTEMATIC NAME: 1-piperidin-4-yl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
MOLECULAR FORMULA: C16H21N3
MOLECULAR WEIGHT: 255.35804
SMILES: C1CNCCC1C2C3=C(CCN2)C4=CC=CC=C4N3
Structure:

CAS RN: 132767-54-5
CAS Name: 1-(3-piperidinyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
OPENEYE Name: 1-(3-piperidyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
IUPAC Name: 1-piperidin-3-yl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
SYSTEMATIC NAME: 1-piperidin-3-yl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
MOLECULAR FORMULA: C16H21N3
MOLECULAR WEIGHT: 255.35804
SMILES: C1CC(CNC1)C2C3=C(CCN2)C4=CC=CC=C4N3
Structure:

CAS RN: 132767-53-4
CAS Name: 1-(2-piperidinyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
OPENEYE Name: 1-(2-piperidyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
IUPAC Name: 1-piperidin-2-yl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
SYSTEMATIC NAME: 1-piperidin-2-yl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
MOLECULAR FORMULA: C16H21N3
MOLECULAR WEIGHT: 255.35804
SMILES: C1CCNC(C1)C2C3=C(CCN2)C4=CC=CC=C4N3
Structure:

CAS RN: 132764-69-3
CAS Name: 3-[1-(4-amino-6,7-dimethoxy-2-quinazolinyl)-4-piperidinyl]-1H-benzimidazol-2-one hydrochloride
OPENEYE Name: 3-[1-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-4-piperidyl]-1H-benzimidazol-2-one hydrochloride
IUPAC Name: 3-[1-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperidin-4-yl]-1H-benzimidazol-2-one hydrochloride
SYSTEMATIC NAME: 3-[1-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperidin-4-yl]-1H-benzimidazol-2-one hydrochloride
MOLECULAR FORMULA: C22H25ClN6O3
MOLECULAR WEIGHT: 456.9253
SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)N4C5=CC=CC=C5NC4=O)N)OC.Cl
Structure:

CAS RN: 132764-68-2
CAS Name: 1-(4-amino-6,7-dimethoxy-2-quinazolinyl)-4-(4-chlorophenyl)-4-piperidinol hydrochloride
OPENEYE Name: 1-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-4-(4-chlorophenyl)piperidin-4-ol hydrochloride
IUPAC Name: 1-(4-amino-6,7-dimethoxyquinazolin-2-yl)-4-(4-chlorophenyl)piperidin-4-ol hydrochloride
SYSTEMATIC NAME: 1-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-4-(4-chlorophenyl)piperidin-4-ol hydrochloride
MOLECULAR FORMULA: C21H24Cl2N4O3
MOLECULAR WEIGHT: 451.34626
SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)(C4=CC=C(C=C4)Cl)O)N)OC.Cl
Structure:

CAS RN: 132764-67-1
CAS Name: 6,7-dimethoxy-2-[4-(4-methoxyphenyl)-1-piperazinyl]-4-quinazolinamine hydrochloride
OPENEYE Name: 6,7-dimethoxy-2-[4-(4-methoxyphenyl)piperazin-1-yl]quinazolin-4-amine hydrochloride
IUPAC Name: 6,7-dimethoxy-2-[4-(4-methoxyphenyl)piperazin-1-yl]quinazolin-4-amine hydrochloride
SYSTEMATIC NAME: 6,7-dimethoxy-2-[4-(4-methoxyphenyl)piperazin-1-yl]quinazolin-4-amine hydrochloride
MOLECULAR FORMULA: C21H26ClN5O3
MOLECULAR WEIGHT: 431.91584
SMILES: COC1=CC=C(C=C1)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC.Cl
Structure:

CAS RN: 132764-66-0
CAS Name: 6,7-dimethoxy-2-[4-(3-methoxyphenyl)-1-piperazinyl]-4-quinazolinamine hydrochloride
OPENEYE Name: 6,7-dimethoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]quinazolin-4-amine hydrochloride
IUPAC Name: 6,7-dimethoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]quinazolin-4-amine hydrochloride
SYSTEMATIC NAME: 6,7-dimethoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]quinazolin-4-amine hydrochloride
MOLECULAR FORMULA: C21H26ClN5O3
MOLECULAR WEIGHT: 431.91584
SMILES: COC1=CC=CC(=C1)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC.Cl
Structure:

CAS RN: 132764-65-9
CAS Name: 6,7-dimethoxy-2-[4-(2-methoxyphenyl)-1-piperazinyl]-4-quinazolinamine hydrochloride
OPENEYE Name: 6,7-dimethoxy-2-[4-(2-methoxyphenyl)piperazin-1-yl]quinazolin-4-amine hydrochloride
IUPAC Name: 6,7-dimethoxy-2-[4-(2-methoxyphenyl)piperazin-1-yl]quinazolin-4-amine hydrochloride
SYSTEMATIC NAME: 6,7-dimethoxy-2-[4-(2-methoxyphenyl)piperazin-1-yl]quinazolin-4-amine hydrochloride
MOLECULAR FORMULA: C21H26ClN5O3
MOLECULAR WEIGHT: 431.91584
SMILES: COC1=CC=CC=C1N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC.Cl
Structure:

CAS RN: 132764-64-8
CAS Name: 6,7-dimethoxy-2-(4-phenyl-1-piperazinyl)-4-quinazolinamine hydrochloride
OPENEYE Name: 6,7-dimethoxy-2-(4-phenylpiperazin-1-yl)quinazolin-4-amine hydrochloride
IUPAC Name: 6,7-dimethoxy-2-(4-phenylpiperazin-1-yl)quinazolin-4-amine hydrochloride
SYSTEMATIC NAME: 6,7-dimethoxy-2-(4-phenylpiperazin-1-yl)quinazolin-4-amine hydrochloride
MOLECULAR FORMULA: C20H24ClN5O2
MOLECULAR WEIGHT: 401.88986
SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C4=CC=CC=C4)N)OC.Cl
Structure:

CAS RN: 132719-65-4
CAS Name: 1-[(4-methoxy-3-thiophenyl)oxy]-3-(propan-2-ylamino)-2-propanol
OPENEYE Name: 1-(isopropylamino)-3-[(4-methoxy-3-thienyl)oxy]propan-2-ol
IUPAC Name: 1-(4-methoxythiophen-3-yl)oxy-3-(propan-2-ylamino)propan-2-ol
SYSTEMATIC NAME: 1-(4-methoxythiophen-3-yl)oxy-3-(propan-2-ylamino)propan-2-ol
MOLECULAR FORMULA: C11H19NO3S
MOLECULAR WEIGHT: 245.33846
SMILES: CC(C)NCC(COC1=CSC=C1OC)O
Structure:

CAS RN: 132719-64-3
CAS Name: 1-[(5-chloro-3-thiophenyl)oxy]-3-(propan-2-ylamino)-2-propanol hydrochloride
OPENEYE Name: 1-[(5-chloro-3-thienyl)oxy]-3-(isopropylamino)propan-2-ol hydrochloride
IUPAC Name: 1-(5-chlorothiophen-3-yl)oxy-3-(propan-2-ylamino)propan-2-ol hydrochloride
SYSTEMATIC NAME: 1-(5-chloranylthiophen-3-yl)oxy-3-(propan-2-ylamino)propan-2-ol hydrochloride
MOLECULAR FORMULA: C10H17Cl2NO2S
MOLECULAR WEIGHT: 286.21848
SMILES: CC(C)NCC(COC1=CSC(=C1)Cl)O.Cl
Structure:

CAS RN: 132706-10-6
CAS Name: 2-[3,5-bis[2-[(4-bromophenyl)methyl-dimethylammonio]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-[(3-bromophenyl)methyl]-dimethylammonium tribromide
OPENEYE Name: 2-[3,5-bis[2-[(4-bromophenyl)methyl-dimethyl-ammonio]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-[(3-bromophenyl)methyl]-dimethyl-ammonium tribromide
IUPAC Name: 2-[3,5-bis[2-[(4-bromophenyl)methyl-dimethylazaniumyl]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-[(3-bromophenyl)methyl]-dimethylazanium tribromide
SYSTEMATIC NAME: 2-[3,5-bis[2-[(4-bromophenyl)methyl-dimethyl-azaniumyl]ethyl]-2,4,6-tris(oxidanylidene)-1,3,5-triazinan-1-yl]ethyl-[(3-bromophenyl)methyl]-dimethyl-azanium tribromide
MOLECULAR FORMULA: C36H48Br6N6O3
MOLECULAR WEIGHT: 1092.22872
SMILES: C[N+](C)(CCN1C(=O)N(C(=O)N(C1=O)CC[N+](C)(C)CC2=CC(=CC=C2)Br)CC[N+](C)(C)CC3=CC=C(C=C3)Br)CC4=CC=C(C=C4)Br.[Br-].[Br-].[Br-]
Structure:

CAS RN: 132684-44-7
CAS Name: 2-[3,5-bis[2-[diethyl-[(4-nitrophenyl)methyl]ammonio]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-diethyl-[(3-nitrophenyl)methyl]ammonium tribromide
OPENEYE Name: 2-[3,5-bis[2-[diethyl-[(4-nitrophenyl)methyl]ammonio]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-diethyl-[(3-nitrophenyl)methyl]ammonium tribromide
IUPAC Name: 2-[3,5-bis[2-[diethyl-[(4-nitrophenyl)methyl]azaniumyl]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-diethyl-[(3-nitrophenyl)methyl]azanium tribromide
SYSTEMATIC NAME: 2-[3,5-bis[2-[diethyl-[(4-nitrophenyl)methyl]azaniumyl]ethyl]-2,4,6-tris(oxidanylidene)-1,3,5-triazinan-1-yl]ethyl-diethyl-[(3-nitrophenyl)methyl]azanium tribromide
MOLECULAR FORMULA: C42H60Br3N9O9
MOLECULAR WEIGHT: 1074.6927
SMILES: CC[N+](CC)(CCN1C(=O)N(C(=O)N(C1=O)CC[N+](CC)(CC)CC2=CC(=CC=C2)[N+](=O)[O-])CC[N+](CC)(CC)CC3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=C(C=C4)[N+](=O)[O-].[Br-].[Br-].[Br-]
Structure:

CAS RN: 132684-43-6
CAS Name: 2-[3,5-bis[2-[dimethyl-[(4-nitrophenyl)methyl]ammonio]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-dimethyl-[(3-nitrophenyl)methyl]ammonium tribromide
OPENEYE Name: 2-[3,5-bis[2-[dimethyl-[(4-nitrophenyl)methyl]ammonio]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-dimethyl-[(3-nitrophenyl)methyl]ammonium tribromide
IUPAC Name: 2-[3,5-bis[2-[dimethyl-[(4-nitrophenyl)methyl]azaniumyl]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-dimethyl-[(3-nitrophenyl)methyl]azanium tribromide
SYSTEMATIC NAME: 2-[3,5-bis[2-[dimethyl-[(4-nitrophenyl)methyl]azaniumyl]ethyl]-2,4,6-tris(oxidanylidene)-1,3,5-triazinan-1-yl]ethyl-dimethyl-[(3-nitrophenyl)methyl]azanium tribromide
MOLECULAR FORMULA: C36H48Br3N9O9
MOLECULAR WEIGHT: 990.53322
SMILES: C[N+](C)(CCN1C(=O)N(C(=O)N(C1=O)CC[N+](C)(C)CC2=CC(=CC=C2)[N+](=O)[O-])CC[N+](C)(C)CC3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=C(C=C4)[N+](=O)[O-].[Br-].[Br-].[Br-]
Structure:

CAS RN: 132684-42-5
CAS Name: (2,3-dimethylphenyl)methyl-[2-[3-[2-[(2,5-dimethylphenyl)methyl-dimethylammonio]ethyl]-5-[2-[(3,4-dimethylphenyl)methyl-dimethylammonio]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl]-dimethylammonium tribromide
OPENEYE Name: (2,3-dimethylphenyl)methyl-[2-[3-[2-[(2,5-dimethylphenyl)methyl-dimethyl-ammonio]ethyl]-5-[2-[(3,4-dimethylphenyl)methyl-dimethyl-ammonio]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl]-dimethyl-ammonium tribromide
IUPAC Name: (2,3-dimethylphenyl)methyl-[2-[3-[2-[(2,5-dimethylphenyl)methyl-dimethylazaniumyl]ethyl]-5-[2-[(3,4-dimethylphenyl)methyl-dimethylazaniumyl]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl]-dimethylazanium tribromide
SYSTEMATIC NAME: (2,3-dimethylphenyl)methyl-[2-[3-[2-[(2,5-dimethylphenyl)methyl-dimethyl-azaniumyl]ethyl]-5-[2-[(3,4-dimethylphenyl)methyl-dimethyl-azaniumyl]ethyl]-2,4,6-tris(oxidanylidene)-1,3,5-triazinan-1-yl]ethyl]-dimethyl-azanium tribromide
MOLECULAR FORMULA: C42H63Br3N6O3
MOLECULAR WEIGHT: 939.70002
SMILES: CC1=CC(=C(C=C1)C)C[N+](C)(C)CCN2C(=O)N(C(=O)N(C2=O)CC[N+](C)(C)CC3=CC=CC(=C3C)C)CC[N+](C)(C)CC4=CC(=C(C=C4)C)C.[Br-].[Br-].[Br-]
Structure:

CAS RN: 132684-41-4
CAS Name: 2-[3,5-bis[2-[dimethyl-[(2-methylphenyl)methyl]ammonio]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-dimethyl-[(3-methylphenyl)methyl]ammonium tribromide
OPENEYE Name: 2-[3,5-bis[2-[dimethyl(o-tolylmethyl)ammonio]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-dimethyl-(m-tolylmethyl)ammonium tribromide
IUPAC Name: 2-[3,5-bis[2-[dimethyl-[(2-methylphenyl)methyl]azaniumyl]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-dimethyl-[(3-methylphenyl)methyl]azanium tribromide
SYSTEMATIC NAME: 2-[3,5-bis[2-[dimethyl-[(2-methylphenyl)methyl]azaniumyl]ethyl]-2,4,6-tris(oxidanylidene)-1,3,5-triazinan-1-yl]ethyl-dimethyl-[(3-methylphenyl)methyl]azanium tribromide
MOLECULAR FORMULA: C39H57Br3N6O3
MOLECULAR WEIGHT: 897.62028
SMILES: CC1=CC(=CC=C1)C[N+](C)(C)CCN2C(=O)N(C(=O)N(C2=O)CC[N+](C)(C)CC3=CC=CC=C3C)CC[N+](C)(C)CC4=CC=CC=C4C.[Br-].[Br-].[Br-]
Structure:

CAS RN: 132684-40-3
CAS Name: 2-[3,5-bis[2-[diethyl-(phenylmethyl)ammonio]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-diethyl-(phenylmethyl)ammonium tribromide
OPENEYE Name: benzyl-[2-[3,5-bis[2-[benzyl(diethyl)ammonio]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl]-diethyl-ammonium tribromide
IUPAC Name: benzyl-[2-[3,5-bis[2-[benzyl(diethyl)azaniumyl]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl]-diethylazanium tribromide
SYSTEMATIC NAME: 2-[3,5-bis[2-[diethyl-(phenylmethyl)azaniumyl]ethyl]-2,4,6-tris(oxidanylidene)-1,3,5-triazinan-1-yl]ethyl-diethyl-(phenylmethyl)azanium tribromide
MOLECULAR FORMULA: C42H63Br3N6O3
MOLECULAR WEIGHT: 939.70002
SMILES: CC[N+](CC)(CCN1C(=O)N(C(=O)N(C1=O)CC[N+](CC)(CC)CC2=CC=CC=C2)CC[N+](CC)(CC)CC3=CC=CC=C3)CC4=CC=CC=C4.[Br-].[Br-].[Br-]
Structure:

CAS RN: 132684-39-0
CAS Name: 2-[3,5-bis[2-[diethyl-(phenylmethyl)ammonio]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-diethyl-(phenylmethyl)ammonium trichloride
OPENEYE Name: benzyl-[2-[3,5-bis[2-[benzyl(diethyl)ammonio]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl]-diethyl-ammonium trichloride
IUPAC Name: benzyl-[2-[3,5-bis[2-[benzyl(diethyl)azaniumyl]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl]-diethylazanium trichloride
SYSTEMATIC NAME: 2-[3,5-bis[2-[diethyl-(phenylmethyl)azaniumyl]ethyl]-2,4,6-tris(oxidanylidene)-1,3,5-triazinan-1-yl]ethyl-diethyl-(phenylmethyl)azanium trichloride
MOLECULAR FORMULA: C42H63Cl3N6O3
MOLECULAR WEIGHT: 806.34702
SMILES: CC[N+](CC)(CCN1C(=O)N(C(=O)N(C1=O)CC[N+](CC)(CC)CC2=CC=CC=C2)CC[N+](CC)(CC)CC3=CC=CC=C3)CC4=CC=CC=C4.[Cl-].[Cl-].[Cl-]
Structure:

CAS RN: 132684-38-9
CAS Name: 2-[3,5-bis[2-[dimethyl-(phenylmethyl)ammonio]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-dimethyl-(phenylmethyl)ammonium trichloride
OPENEYE Name: benzyl-[2-[3,5-bis[2-[benzyl(dimethyl)ammonio]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl]-dimethyl-ammonium trichloride
IUPAC Name: benzyl-[2-[3,5-bis[2-[benzyl(dimethyl)azaniumyl]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl]-dimethylazanium trichloride
SYSTEMATIC NAME: 2-[3,5-bis[2-[dimethyl-(phenylmethyl)azaniumyl]ethyl]-2,4,6-tris(oxidanylidene)-1,3,5-triazinan-1-yl]ethyl-dimethyl-(phenylmethyl)azanium trichloride
MOLECULAR FORMULA: C36H51Cl3N6O3
MOLECULAR WEIGHT: 722.18754
SMILES: C[N+](C)(CCN1C(=O)N(C(=O)N(C1=O)CC[N+](C)(C)CC2=CC=CC=C2)CC[N+](C)(C)CC3=CC=CC=C3)CC4=CC=CC=C4.[Cl-].[Cl-].[Cl-]
Structure:

CAS RN: 132684-37-8
CAS Name: 2-[[4,6-bis[2-[diethyl-(phenylmethyl)ammonio]ethoxy]-1,3,5-triazin-2-yl]oxy]ethyl-diethyl-(phenylmethyl)ammonium trichloride
OPENEYE Name: benzyl-[2-[[4,6-bis[2-[benzyl(diethyl)ammonio]ethoxy]-1,3,5-triazin-2-yl]oxy]ethyl]-diethyl-ammonium trichloride
IUPAC Name: benzyl-[2-[[4,6-bis[2-[benzyl(diethyl)azaniumyl]ethoxy]-1,3,5-triazin-2-yl]oxy]ethyl]-diethylazanium trichloride
SYSTEMATIC NAME: 2-[[4,6-bis[2-[diethyl-(phenylmethyl)azaniumyl]ethoxy]-1,3,5-triazin-2-yl]oxy]ethyl-diethyl-(phenylmethyl)azanium trichloride
MOLECULAR FORMULA: C42H63Cl3N6O3
MOLECULAR WEIGHT: 806.34702
SMILES: CC[N+](CC)(CCOC1=NC(=NC(=N1)OCC[N+](CC)(CC)CC2=CC=CC=C2)OCC[N+](CC)(CC)CC3=CC=CC=C3)CC4=CC=CC=C4.[Cl-].[Cl-].[Cl-]
Structure:

CAS RN: 132684-36-7
CAS Name: 2-[[4,6-bis[2-[dimethyl-(phenylmethyl)ammonio]ethoxy]-1,3,5-triazin-2-yl]oxy]ethyl-dimethyl-(phenylmethyl)ammonium trichloride
OPENEYE Name: benzyl-[2-[[4,6-bis[2-[benzyl(dimethyl)ammonio]ethoxy]-1,3,5-triazin-2-yl]oxy]ethyl]-dimethyl-ammonium trichloride
IUPAC Name: benzyl-[2-[[4,6-bis[2-[benzyl(dimethyl)azaniumyl]ethoxy]-1,3,5-triazin-2-yl]oxy]ethyl]-dimethylazanium trichloride
SYSTEMATIC NAME: 2-[[4,6-bis[2-[dimethyl-(phenylmethyl)azaniumyl]ethoxy]-1,3,5-triazin-2-yl]oxy]ethyl-dimethyl-(phenylmethyl)azanium trichloride
MOLECULAR FORMULA: C36H51Cl3N6O3
MOLECULAR WEIGHT: 722.18754
SMILES: C[N+](C)(CCOC1=NC(=NC(=N1)OCC[N+](C)(C)CC2=CC=CC=C2)OCC[N+](C)(C)CC3=CC=CC=C3)CC4=CC=CC=C4.[Cl-].[Cl-].[Cl-]
Structure:

CAS RN: 132681-02-8
CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,3-dimethyl-4H-isoquinoline; 2-hydroxybenzoic acid
OPENEYE Name: 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,3-dimethyl-4H-isoquinoline; 2-hydroxybenzoic acid
IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,3-dimethyl-4H-isoquinoline; 2-hydroxybenzoic acid
SYSTEMATIC NAME: 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,3-dimethyl-4H-isoquinoline; 2-oxidanylbenzoic acid
MOLECULAR FORMULA: C29H33NO7
MOLECULAR WEIGHT: 507.57482
SMILES: CC1(CC2=CC(=C(C=C2C(=N1)CC3=CC(=C(C=C3)OC)OC)OC)OC)C.C1=CC=C(C(=C1)C(=O)O)O
Structure:

CAS RN: 132680-97-8
CAS Name: 2-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)-N,N-dimethylethanamine dihydroiodide
OPENEYE Name: 2-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)-N,N-dimethyl-ethanamine dihydroiodide
IUPAC Name: 2-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)-N,N-dimethylethanamine dihydroiodide
SYSTEMATIC NAME: 2-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)-N,N-dimethyl-ethanamine dihydroiodide
MOLECULAR FORMULA: C17H28I2N2O2
MOLECULAR WEIGHT: 546.22536
SMILES: CC1(CC2=CC(=C(C=C2C(=N1)CCN(C)C)OC)OC)C.I.I
Structure:

CAS RN: 132634-48-1
CAS Name: 5-chloro-6-[(1R,2S)-2-[4-(4-fluorophenyl)-1-piperazinyl]-1-hydroxypropyl]-3-methyl-1,3-benzoxazol-2-one
OPENEYE Name: 5-chloro-6-[(1R,2S)-2-[4-(4-fluorophenyl)piperazin-1-yl]-1-hydroxy-propyl]-3-methyl-1,3-benzoxazol-2-one
IUPAC Name: 5-chloro-6-[(1R,2S)-2-[4-(4-fluorophenyl)piperazin-1-yl]-1-hydroxypropyl]-3-methyl-1,3-benzoxazol-2-one
SYSTEMATIC NAME: 5-chloranyl-6-[(1R,2S)-2-[4-(4-fluorophenyl)piperazin-1-yl]-1-oxidanyl-propyl]-3-methyl-1,3-benzoxazol-2-one
MOLECULAR FORMULA: C21H23ClFN3O3
MOLECULAR WEIGHT: 419.877023
SMILES: C[C@@H]([C@@H](C1=CC2=C(C=C1Cl)N(C(=O)O2)C)O)N3CCN(CC3)C4=CC=C(C=C4)F
Structure:

CAS RN: 132634-46-9
CAS Name: 5-chloro-6-[(1R,2S)-1-hydroxy-2-[4-(2-methoxyphenyl)-1-piperazinyl]propyl]-3-methyl-1,3-benzoxazol-2-one
OPENEYE Name: 5-chloro-6-[(1R,2S)-1-hydroxy-2-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-3-methyl-1,3-benzoxazol-2-one
IUPAC Name: 5-chloro-6-[(1R,2S)-1-hydroxy-2-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-3-methyl-1,3-benzoxazol-2-one
SYSTEMATIC NAME: 5-chloranyl-6-[(1R,2S)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1-oxidanyl-propyl]-3-methyl-1,3-benzoxazol-2-one
MOLECULAR FORMULA: C22H26ClN3O4
MOLECULAR WEIGHT: 431.91254
SMILES: C[C@@H]([C@@H](C1=CC2=C(C=C1Cl)N(C(=O)O2)C)O)N3CCN(CC3)C4=CC=CC=C4OC
Structure:

CAS RN: 132634-45-8
CAS Name: 5-chloro-6-[(1R,2R)-1-hydroxy-2-[4-(2-methoxyphenyl)-1-piperazinyl]propyl]-3-methyl-1,3-benzoxazol-2-one
OPENEYE Name: 5-chloro-6-[(1R,2R)-1-hydroxy-2-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-3-methyl-1,3-benzoxazol-2-one
IUPAC Name: 5-chloro-6-[(1R,2R)-1-hydroxy-2-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-3-methyl-1,3-benzoxazol-2-one
SYSTEMATIC NAME: 5-chloranyl-6-[(1R,2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1-oxidanyl-propyl]-3-methyl-1,3-benzoxazol-2-one
MOLECULAR FORMULA: C22H26ClN3O4
MOLECULAR WEIGHT: 431.91254
SMILES: C[C@H]([C@@H](C1=CC2=C(C=C1Cl)N(C(=O)O2)C)O)N3CCN(CC3)C4=CC=CC=C4OC
Structure:

CAS RN: 132634-44-7
CAS Name: 5-chloro-6-[(1R,2S)-1-hydroxy-2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]propyl]-3-methyl-1,3-benzoxazol-2-one
OPENEYE Name: 5-chloro-6-[(1R,2S)-1-hydroxy-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propyl]-3-methyl-1,3-benzoxazol-2-one
IUPAC Name: 5-chloro-6-[(1R,2S)-1-hydroxy-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propyl]-3-methyl-1,3-benzoxazol-2-one
SYSTEMATIC NAME: 5-chloranyl-3-methyl-6-[(1R,2S)-1-oxidanyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propyl]-1,3-benzoxazol-2-one
MOLECULAR FORMULA: C22H23ClF3N3O3
MOLECULAR WEIGHT: 469.88453
SMILES: C[C@@H]([C@@H](C1=CC2=C(C=C1Cl)N(C(=O)O2)C)O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F
Structure:

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