CAS RN: 7032-90-8
CAS Name: 3-(4-morpholinyl)-3-phenyl-1-propanol hydrochloride
OPENEYE Name: 3-morpholino-3-phenyl-propan-1-ol hydrochloride
IUPAC Name: 3-morpholin-4-yl-3-phenylpropan-1-ol hydrochloride
SYSTEMATIC NAME: 3-morpholin-4-yl-3-phenyl-propan-1-ol hydrochloride
MOLECULAR FORMULA: C13H20ClNO2
MOLECULAR WEIGHT: 257.7564
SMILES: C1COCCN1C(CCO)C2=CC=CC=C2.Cl
Structure:
CAS RN: 7032-68-0
CAS Name: 3-(4-morpholinyl)-3-phenylpropanoic acid methyl ester hydrochloride
OPENEYE Name: methyl 3-morpholino-3-phenyl-propanoate hydrochloride
IUPAC Name: methyl 3-morpholin-4-yl-3-phenylpropanoate hydrochloride
SYSTEMATIC NAME: methyl 3-morpholin-4-yl-3-phenyl-propanoate hydrochloride
MOLECULAR FORMULA: C14H20ClNO3
MOLECULAR WEIGHT: 285.7665
SMILES: COC(=O)CC(C1=CC=CC=C1)N2CCOCC2.Cl
Structure:
CAS RN: 7012-67-1
CAS Name: 2-(4-morpholinyl)-3-phenylpropanoic acid methyl ester hydrochloride
OPENEYE Name: methyl 2-morpholino-3-phenyl-propanoate hydrochloride
IUPAC Name: methyl 2-morpholin-4-yl-3-phenylpropanoate hydrochloride
SYSTEMATIC NAME: methyl 2-morpholin-4-yl-3-phenyl-propanoate hydrochloride
MOLECULAR FORMULA: C14H20ClNO3
MOLECULAR WEIGHT: 285.7665
SMILES: COC(=O)C(CC1=CC=CC=C1)N2CCOCC2.Cl
Structure:
CAS RN: 7032-43-1
CAS Name: 3-phenyl-2-(1-piperidinyl)-1-propanol hydrochloride
OPENEYE Name: 3-phenyl-2-(1-piperidyl)propan-1-ol hydrochloride
IUPAC Name: 3-phenyl-2-piperidin-1-ylpropan-1-ol hydrochloride
SYSTEMATIC NAME: 3-phenyl-2-piperidin-1-yl-propan-1-ol hydrochloride
MOLECULAR FORMULA: C14H22ClNO
MOLECULAR WEIGHT: 255.78358
SMILES: C1CCN(CC1)C(CC2=CC=CC=C2)CO.Cl
Structure:
CAS RN: 7079-02-9
CAS Name: 3-phenyl-2-(1-piperidinyl)propanoic acid methyl ester hydrochloride
OPENEYE Name: methyl 3-phenyl-2-(1-piperidyl)propanoate hydrochloride
IUPAC Name: methyl 3-phenyl-2-piperidin-1-ylpropanoate hydrochloride
SYSTEMATIC NAME: methyl 3-phenyl-2-piperidin-1-yl-propanoate hydrochloride
MOLECULAR FORMULA: C15H22ClNO2
MOLECULAR WEIGHT: 283.79368
SMILES: COC(=O)C(CC1=CC=CC=C1)N2CCCCC2.Cl
Structure:
CAS RN: 14878-96-7
CAS Name: carbon monoxide; iron; iron(2+); methanethiolate
OPENEYE Name: ferrous; carbon monoxide; iron; methanethiolate
IUPAC Name: carbon monoxide; iron; iron(2+); methanethiolate
SYSTEMATIC NAME: carbon monoxide; iron; iron(2+); methanethiolate
MOLECULAR FORMULA: C8H6Fe2O6S2
MOLECULAR WEIGHT: 373.94964
SMILES: C[S-].C[S-].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe].[Fe+2]
Structure:
CAS RN: 39811-02-4
CAS Name: (5,6-dichloro-1H-benzimidazol-2-yl)methanol hydrochloride
OPENEYE Name: (5,6-dichloro-1H-benzimidazol-2-yl)methanol hydrochloride
IUPAC Name: (5,6-dichloro-1H-benzimidazol-2-yl)methanol hydrochloride
SYSTEMATIC NAME: [5,6-bis(chloranyl)-1H-benzimidazol-2-yl]methanol hydrochloride
MOLECULAR FORMULA: C8H7Cl3N2O
MOLECULAR WEIGHT: 253.51298
SMILES: C1=C2C(=CC(=C1Cl)Cl)N=C(N2)CO.Cl
Structure:
CAS RN: 17400-11-2
CAS Name: N-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propyl]-4-(2-bromo-1-oxoethyl)benzenesulfonamide hydrobromide
OPENEYE Name: N-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propyl]-4-(2-bromoacetyl)benzenesulfonamide hydrobromide
IUPAC Name: N-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propyl]-4-(2-bromoacetyl)benzenesulfonamide hydrobromide
SYSTEMATIC NAME: N-[3-(2-azanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)propyl]-4-(2-bromanylethanoyl)benzenesulfonamide hydrobromide
MOLECULAR FORMULA: C16H20Br2N4O4S
MOLECULAR WEIGHT: 524.2274
SMILES: CC1=C(C(=O)N=C(N1)N)CCCNS(=O)(=O)C2=CC=C(C=C2)C(=O)CBr.Br
Structure:
CAS RN: 16048-73-0
CAS Name: 4-methyl-4-[3-(2-methyl-1,3,3a,3b,4,5,6,7,8,9,10,11,11a,11b-tetradecahydrophenanthro[9,10-c]pyrrol-2-ium-2-yl)propyl]morpholin-4-ium iodide
OPENEYE Name: 4-methyl-4-[3-(2-methyl-1,3,3a,3b,4,5,6,7,8,9,10,11,11a,11b-tetradecahydrophenanthro[9,10-c]pyrrol-2-ium-2-yl)propyl]morpholin-4-ium iodide
IUPAC Name: 4-methyl-4-[3-(2-methyl-1,3,3a,3b,4,5,6,7,8,9,10,11,11a,11b-tetradecahydrophenanthro[9,10-c]pyrrol-2-ium-2-yl)propyl]morpholin-4-ium iodide
SYSTEMATIC NAME: 4-methyl-4-[3-(2-methyl-1,3,3a,3b,4,5,6,7,8,9,10,11,11a,11b-tetradecahydrophenanthro[9,10-c]pyrrol-2-ium-2-yl)propyl]morpholin-4-ium iodide
MOLECULAR FORMULA: C25H44IN2O+
MOLECULAR WEIGHT: 515.53413
SMILES: C[N+]1(CCOCC1)CCC[N+]2(CC3C4CCCCC4=C5CCCCC5C3C2)C.[I-]
Structure:
CAS RN: 16048-72-9
CAS Name: 4-[3-(1,3,3a,3b,4,5,6,7,8,9,10,11,11a,11b-tetradecahydrophenanthro[9,10-c]pyrrol-2-yl)propyl]morpholine hydrochloride
OPENEYE Name: 4-[3-(1,3,3a,3b,4,5,6,7,8,9,10,11,11a,11b-tetradecahydrophenanthro[9,10-c]pyrrol-2-yl)propyl]morpholine hydrochloride
IUPAC Name: 4-[3-(1,3,3a,3b,4,5,6,7,8,9,10,11,11a,11b-tetradecahydrophenanthro[9,10-c]pyrrol-2-yl)propyl]morpholine hydrochloride
SYSTEMATIC NAME: 4-[3-(1,3,3a,3b,4,5,6,7,8,9,10,11,11a,11b-tetradecahydrophenanthro[9,10-c]pyrrol-2-yl)propyl]morpholine hydrochloride
MOLECULAR FORMULA: C23H39ClN2O
MOLECULAR WEIGHT: 395.02156
SMILES: C1CCC2=C3CCCCC3C4CN(CC4C2C1)CCCN5CCOCC5.Cl
Structure:
CAS RN: 16048-70-7
CAS Name: 2-(1,3,3a,3b,4,5,6,7,8,9,10,11,11a,11b-tetradecahydrophenanthro[9,10-c]pyrrol-2-yl)-N,N-dimethylethanamine hydrochloride
OPENEYE Name: 2-(1,3,3a,3b,4,5,6,7,8,9,10,11,11a,11b-tetradecahydrophenanthro[9,10-c]pyrrol-2-yl)-N,N-dimethyl-ethanamine hydrochloride
IUPAC Name: 2-(1,3,3a,3b,4,5,6,7,8,9,10,11,11a,11b-tetradecahydrophenanthro[9,10-c]pyrrol-2-yl)-N,N-dimethylethanamine hydrochloride
SYSTEMATIC NAME: 2-(1,3,3a,3b,4,5,6,7,8,9,10,11,11a,11b-tetradecahydrophenanthro[9,10-c]pyrrol-2-yl)-N,N-dimethyl-ethanamine hydrochloride
MOLECULAR FORMULA: C20H35ClN2
MOLECULAR WEIGHT: 338.9583
SMILES: CN(C)CCN1CC2C3CCCCC3=C4CCCCC4C2C1.Cl
Structure:
CAS RN: 1194-38-3
CAS Name: 3-azaspiro[4.5]decane hydrobromide
OPENEYE Name: 3-azaspiro[4.5]decane hydrobromide
IUPAC Name: 3-azaspiro[4.5]decane hydrobromide
SYSTEMATIC NAME: 3-azaspiro[4.5]decane hydrobromide
MOLECULAR FORMULA: C9H18BrN
MOLECULAR WEIGHT: 220.14992
SMILES: C1CCC2(CC1)CCNC2.Br
Structure:
CAS RN: 1075-92-9
CAS Name: 4-methyl-9-azaspiro[5.5]undecane hydrochloride
OPENEYE Name: 4-methyl-9-azaspiro[5.5]undecane hydrochloride
IUPAC Name: 4-methyl-9-azaspiro[5.5]undecane hydrochloride
SYSTEMATIC NAME: 4-methyl-9-azaspiro[5.5]undecane hydrochloride
MOLECULAR FORMULA: C11H22ClN
MOLECULAR WEIGHT: 203.75208
SMILES: CC1CCCC2(C1)CCNCC2.Cl
Structure:
CAS RN: 1080-31-5
CAS Name: spiro[2,3,4,4a,5,6,8,8a-octahydro-1H-naphthalene-7,4'-piperidine] hydrochloride
OPENEYE Name: spiro[decalin-2,4'-piperidine] hydrochloride
IUPAC Name: spiro[2,3,4,4a,5,6,8,8a-octahydro-1H-naphthalene-7,4'-piperidine] hydrochloride
SYSTEMATIC NAME: spiro[2,3,4,4a,5,6,8,8a-octahydro-1H-naphthalene-7,4'-piperidine] hydrochloride
MOLECULAR FORMULA: C14H26ClN
MOLECULAR WEIGHT: 243.81594
SMILES: C1CCC2CC3(CCC2C1)CCNCC3.Cl
Structure:
CAS RN: 1074-72-2
CAS Name: 3-methyl-8-azaspiro[4.5]decane hydrochloride
OPENEYE Name: 3-methyl-8-azaspiro[4.5]decane hydrochloride
IUPAC Name: 3-methyl-8-azaspiro[4.5]decane hydrochloride
SYSTEMATIC NAME: 3-methyl-8-azaspiro[4.5]decane hydrochloride
MOLECULAR FORMULA: C10H20ClN
MOLECULAR WEIGHT: 189.7255
SMILES: CC1CCC2(C1)CCNCC2.Cl
Structure:
CAS RN: 1206-27-5
CAS Name: 3-tert-butyl-9-azaspiro[5.5]undecane hydrochloride
OPENEYE Name: 3-tert-butyl-9-azaspiro[5.5]undecane hydrochloride
IUPAC Name: 3-tert-butyl-9-azaspiro[5.5]undecane hydrochloride
SYSTEMATIC NAME: 3-tert-butyl-9-azaspiro[5.5]undecane hydrochloride
MOLECULAR FORMULA: C14H28ClN
MOLECULAR WEIGHT: 245.83182
SMILES: CC(C)(C)C1CCC2(CC1)CCNCC2.Cl
Structure:
CAS RN: 1197-83-7
CAS Name: 3-azaspiro[5.6]dodecane hydrochloride
OPENEYE Name: 3-azaspiro[5.6]dodecane hydrochloride
IUPAC Name: 3-azaspiro[5.6]dodecane hydrochloride
SYSTEMATIC NAME: 3-azaspiro[5.6]dodecane hydrochloride
MOLECULAR FORMULA: C11H22ClN
MOLECULAR WEIGHT: 203.75208
SMILES: C1CCCC2(CC1)CCNCC2.Cl
Structure:
CAS RN: 1075-95-2
CAS Name: 3-methyl-9-azaspiro[5.5]undecane hydrochloride
OPENEYE Name: 3-methyl-9-azaspiro[5.5]undecane hydrochloride
IUPAC Name: 3-methyl-9-azaspiro[5.5]undecane hydrochloride
SYSTEMATIC NAME: 3-methyl-9-azaspiro[5.5]undecane hydrochloride
MOLECULAR FORMULA: C11H22ClN
MOLECULAR WEIGHT: 203.75208
SMILES: CC1CCC2(CC1)CCNCC2.Cl
Structure:
CAS RN: 17162-23-1
CAS Name: N-[(5-ethoxy-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]-1-butanamine hydrochloride
OPENEYE Name: N-[(5-ethoxy-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]butan-1-amine hydrochloride
IUPAC Name: N-[(5-ethoxy-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]butan-1-amine hydrochloride
SYSTEMATIC NAME: N-[(5-ethoxy-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]butan-1-amine hydrochloride
MOLECULAR FORMULA: C15H24ClNO3
MOLECULAR WEIGHT: 301.80896
SMILES: CCCCNCC1COC2=C(O1)C(=CC=C2)OCC.Cl
Structure:
CAS RN: 102433-29-4
CAS Name: 1-[2-(dimethylamino)ethyl]-3-(1-naphthalenyl)urea hydrochloride
OPENEYE Name: 1-[2-(dimethylamino)ethyl]-3-(1-naphthyl)urea hydrochloride
IUPAC Name: 1-[2-(dimethylamino)ethyl]-3-naphthalen-1-ylurea hydrochloride
SYSTEMATIC NAME: 1-[2-(dimethylamino)ethyl]-3-naphthalen-1-yl-urea hydrochloride
MOLECULAR FORMULA: C15H20ClN3O
MOLECULAR WEIGHT: 293.7918
SMILES: CN(C)CCNC(=O)NC1=CC=CC2=CC=CC=C21.Cl
Structure:
CAS RN: 55145-96-5
CAS Name: bis[4-(2,5-dioxo-1-pyrrolidinyl)phenyl]iodonium chloride
OPENEYE Name: bis[4-(2,5-dioxopyrrolidin-1-yl)phenyl]iodonium chloride
IUPAC Name: bis[4-(2,5-dioxopyrrolidin-1-yl)phenyl]iodanium chloride
SYSTEMATIC NAME: bis[4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]phenyl]iodanium chloride
MOLECULAR FORMULA: C20H16ClIN2O4
MOLECULAR WEIGHT: 510.70951
SMILES: C1CC(=O)N(C1=O)C2=CC=C(C=C2)[I+]C3=CC=C(C=C3)N4C(=O)CCC4=O.[Cl-]
Structure:
CAS RN: 55145-90-9
CAS Name: (4-aminophenyl)-phenyliodonium bromide
OPENEYE Name: (4-aminophenyl)-phenyl-iodonium bromide
IUPAC Name: (4-aminophenyl)-phenyliodanium bromide
SYSTEMATIC NAME: (4-aminophenyl)-phenyl-iodanium bromide
MOLECULAR FORMULA: C12H11BrIN
MOLECULAR WEIGHT: 376.03091
SMILES: C1=CC=C(C=C1)[I+]C2=CC=C(C=C2)N.[Br-]
Structure:
CAS RN: 23351-89-5
CAS Name: (3-nitrophenyl)-phenyliodonium bromide
OPENEYE Name: (3-nitrophenyl)-phenyl-iodonium bromide
IUPAC Name: (3-nitrophenyl)-phenyliodanium bromide
SYSTEMATIC NAME: (3-nitrophenyl)-phenyl-iodanium bromide
MOLECULAR FORMULA: C12H9BrINO2
MOLECULAR WEIGHT: 406.01383
SMILES: C1=CC=C(C=C1)[I+]C2=CC=CC(=C2)[N+](=O)[O-].[Br-]
Structure:
CAS RN: 59696-27-4
CAS Name: (4-bromophenyl)-phenyliodonium bromide
OPENEYE Name: (4-bromophenyl)-phenyl-iodonium bromide
IUPAC Name: (4-bromophenyl)-phenyliodanium bromide
SYSTEMATIC NAME: (4-bromophenyl)-phenyl-iodanium bromide
MOLECULAR FORMULA: C12H9Br2I
MOLECULAR WEIGHT: 439.91233
SMILES: C1=CC=C(C=C1)[I+]C2=CC=C(C=C2)Br.[Br-]
Structure:
CAS RN: 2990-24-1
CAS Name: 4-methylbenzenesulfonic acid 3-[N-[3-(4-methylphenyl)sulfonyloxypropyl]anilino]propyl ester hydrochloride
OPENEYE Name: 3-[N-[3-(p-tolylsulfonyloxy)propyl]anilino]propyl 4-methylbenzenesulfonate hydrochloride
IUPAC Name: 3-[N-[3-(4-methylphenyl)sulfonyloxypropyl]anilino]propyl 4-methylbenzenesulfonate hydrochloride
SYSTEMATIC NAME: 3-[3-(4-methylphenyl)sulfonyloxypropyl-phenyl-amino]propyl 4-methylbenzenesulfonate hydrochloride
MOLECULAR FORMULA: C26H32ClNO6S2
MOLECULAR WEIGHT: 554.11838
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCCCN(CCCOS(=O)(=O)C2=CC=C(C=C2)C)C3=CC=CC=C3.Cl
Structure:
CAS RN: 3415-55-2
CAS Name: methanesulfonic acid 2-[methyl-[4-[methyl(2-methylsulfonyloxyethyl)amino]butyl]amino]ethyl ester hydrochloride
OPENEYE Name: 2-[methyl-[4-[methyl(2-methylsulfonyloxyethyl)amino]butyl]amino]ethyl methanesulfonate hydrochloride
IUPAC Name: 2-[methyl-[4-[methyl(2-methylsulfonyloxyethyl)amino]butyl]amino]ethyl methanesulfonate hydrochloride
SYSTEMATIC NAME: 2-[methyl-[4-[methyl(2-methylsulfonyloxyethyl)amino]butyl]amino]ethyl methanesulfonate hydrochloride
MOLECULAR FORMULA: C12H29ClN2O6S2
MOLECULAR WEIGHT: 396.95146
SMILES: CN(CCCCN(C)CCOS(=O)(=O)C)CCOS(=O)(=O)C.Cl
Structure:
CAS RN: 16059-31-7
CAS Name: 2-[bis(2-chloroethyl)amino]-1-[2-[[2-[[1-[(3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-oxomethyl]-1-pyrrolidinyl]-oxomethyl]-1-pyrrolidinyl]ethanone hydrochloride
OPENEYE Name: 2-[bis(2-chloroethyl)amino]-1-[2-[2-[1-[(3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl]pyrrolidine-1-carbonyl]pyrrolidin-1-yl]ethanone hydrochloride
IUPAC Name: 2-[bis(2-chloroethyl)amino]-1-[2-[2-[1-[(3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl]pyrrolidine-1-carbonyl]pyrrolidin-1-yl]ethanone hydrochloride
SYSTEMATIC NAME: 2-[bis(2-chloroethyl)amino]-1-[2-[2-[[1-[(3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]carbonyl]pyrrolidin-1-yl]carbonylpyrrolidin-1-yl]ethanone hydrochloride
MOLECULAR FORMULA: C45H64Cl3N5O7
MOLECULAR WEIGHT: 893.37796
SMILES: CCC1CN2CCC3=CC(=C(C=C3C2CC1CC4C5=CC(=C(C=C5CCN4C(=O)C6CCCN6C(=O)C7CCCN7C(=O)CN(CCCl)CCCl)OC)OC)OC)OC.Cl
Structure:
CAS RN: 21680-77-3
CAS Name: N,N-dimethyl-4-(trifluoromethyl)-9-azaspiro[5.5]undecan-9-amine hydrochloride
OPENEYE Name: N,N-dimethyl-4-(trifluoromethyl)-9-azaspiro[5.5]undecan-9-amine hydrochloride
IUPAC Name: N,N-dimethyl-4-(trifluoromethyl)-9-azaspiro[5.5]undecan-9-amine hydrochloride
SYSTEMATIC NAME: N,N-dimethyl-4-(trifluoromethyl)-9-azaspiro[5.5]undecan-9-amine hydrochloride
MOLECULAR FORMULA: C13H24ClF3N2
MOLECULAR WEIGHT: 300.79127
SMILES: CN(C)N1CCC2(CCCC(C2)C(F)(F)F)CC1.Cl
Structure:
CAS RN: 5696-15-1
CAS Name: 2-(tert-butylamino)-1-(2,5-dimethoxyphenyl)-1-propanol chloride
OPENEYE Name: 2-(tert-butylamino)-1-(2,5-dimethoxyphenyl)propan-1-ol chloride
IUPAC Name: 2-(tert-butylamino)-1-(2,5-dimethoxyphenyl)propan-1-ol chloride
SYSTEMATIC NAME: 2-(tert-butylamino)-1-(2,5-dimethoxyphenyl)propan-1-ol chloride
MOLECULAR FORMULA: C15H25ClNO3-
MOLECULAR WEIGHT: 302.8169
SMILES: CC(C(C1=C(C=CC(=C1)OC)OC)O)NC(C)(C)C.[Cl-]
Structure:
CAS RN: 13283-99-3
CAS Name: 5-(2-hydroxyethyl)-4-(hydroxymethyl)-2-methyl-3-pyridinol hydrochloride
OPENEYE Name: 5-(2-hydroxyethyl)-4-(hydroxymethyl)-2-methyl-pyridin-3-ol hydrochloride
IUPAC Name: 5-(2-hydroxyethyl)-4-(hydroxymethyl)-2-methylpyridin-3-ol hydrochloride
SYSTEMATIC NAME: 5-(2-hydroxyethyl)-4-(hydroxymethyl)-2-methyl-pyridin-3-ol hydrochloride
MOLECULAR FORMULA: C9H14ClNO3
MOLECULAR WEIGHT: 219.66536
SMILES: CC1=NC=C(C(=C1O)CO)CCO.Cl
Structure:
CAS RN: 33713-48-3
CAS Name: sodium 4-[2-(2-amino-4-oxo-5,6,7,8-tetrahydro-1H-pteridin-6-yl)ethylamino]benzoic acid
OPENEYE Name: sodium 4-[2-(2-amino-4-oxo-5,6,7,8-tetrahydro-1H-pteridin-6-yl)ethylamino]benzoic acid
IUPAC Name: sodium 4-[2-(2-amino-4-oxo-5,6,7,8-tetrahydro-1H-pteridin-6-yl)ethylamino]benzoic acid
SYSTEMATIC NAME: sodium 4-[2-(2-azanyl-4-oxidanylidene-5,6,7,8-tetrahydro-1H-pteridin-6-yl)ethylamino]benzoic acid
MOLECULAR FORMULA: C15H18N6NaO3+
MOLECULAR WEIGHT: 353.33159
SMILES: C1C(NC2=C(N1)NC(=NC2=O)N)CCNC3=CC=C(C=C3)C(=O)O.[Na+]
Structure:
CAS RN: 17478-51-2
CAS Name: 1-[3-amino-4,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]-5-methylpyrimidine-2,4-dione hydrochloride
OPENEYE Name: 1-[3-amino-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]-5-methyl-pyrimidine-2,4-dione hydrochloride
IUPAC Name: 1-[3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-5-methylpyrimidine-2,4-dione hydrochloride
SYSTEMATIC NAME: 1-[3-azanyl-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]-5-methyl-pyrimidine-2,4-dione hydrochloride
MOLECULAR FORMULA: C11H18ClN3O6
MOLECULAR WEIGHT: 323.73012
SMILES: CC1=CN(C(=O)NC1=O)C2C(C(C(C(O2)CO)O)O)N.Cl
Structure:
CAS RN: 77350-51-7
CAS Name: [(E)-3-bicyclo[2.2.1]heptanylideneamino]-trimethylammonium iodide
OPENEYE Name: trimethyl-[(E)-norbornan-2-ylideneamino]ammonium iodide
IUPAC Name: [(E)-3-bicyclo[2.2.1]heptanylideneamino]-trimethylazanium iodide
SYSTEMATIC NAME: [(E)-3-bicyclo[2.2.1]heptanylideneamino]-trimethyl-azanium iodide
MOLECULAR FORMULA: C10H19IN2
MOLECULAR WEIGHT: 294.17573
SMILES: C[N+](C)(C)/N=C/1\CC2CCC1C2.[I-]
Structure:
CAS RN: 17415-71-3
CAS Name: 4-amino-N-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propyl]benzenesulfonamide hydrochloride
OPENEYE Name: 4-amino-N-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propyl]benzenesulfonamide hydrochloride
IUPAC Name: 4-amino-N-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propyl]benzenesulfonamide hydrochloride
SYSTEMATIC NAME: 4-azanyl-N-[3-(2-azanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)propyl]benzenesulfonamide hydrochloride
MOLECULAR FORMULA: C14H20ClN5O3S
MOLECULAR WEIGHT: 373.8583
SMILES: CC1=C(C(=O)N=C(N1)N)CCCNS(=O)(=O)C2=CC=C(C=C2)N.Cl
Structure:
CAS RN: 13176-40-4
CAS Name: (2-oxocyclohexyl)-triphenylphosphonium bromide
OPENEYE Name: (2-oxocyclohexyl)-triphenyl-phosphonium bromide
IUPAC Name: (2-oxocyclohexyl)-triphenylphosphanium bromide
SYSTEMATIC NAME: (2-oxidanylidenecyclohexyl)-triphenyl-phosphanium bromide
MOLECULAR FORMULA: C24H24BrOP
MOLECULAR WEIGHT: 439.324521
SMILES: C1CCC(=O)C(C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]
Structure:
CAS RN: 19254-98-9
CAS Name: (2-oxo-1,2-diphenylethyl)-triphenylphosphonium chloride
OPENEYE Name: (2-oxo-1,2-diphenyl-ethyl)-triphenyl-phosphonium chloride
IUPAC Name: (2-oxo-1,2-diphenylethyl)-triphenylphosphanium chloride
SYSTEMATIC NAME: (2-oxidanylidene-1,2-diphenyl-ethyl)-triphenyl-phosphanium chloride
MOLECULAR FORMULA: C32H26ClOP
MOLECULAR WEIGHT: 492.975001
SMILES: C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Cl-]
Structure:
CAS RN: 22319-47-7
CAS Name: (3-ethoxy-3-oxo-2-phenylpropyl)-diethyl-methylammonium iodide
OPENEYE Name: (3-ethoxy-3-oxo-2-phenyl-propyl)-diethyl-methyl-ammonium iodide
IUPAC Name: (3-ethoxy-3-oxo-2-phenylpropyl)-diethyl-methylazanium iodide
SYSTEMATIC NAME: (3-ethoxy-3-oxidanylidene-2-phenyl-propyl)-diethyl-methyl-azanium iodide
MOLECULAR FORMULA: C16H26INO2
MOLECULAR WEIGHT: 391.28761
SMILES: CC[N+](C)(CC)CC(C1=CC=CC=C1)C(=O)OCC.[I-]
Structure:
CAS RN: 1792-88-7
CAS Name: 2,4-dimethyl-3H-1,5-benzodiazepine hydrochloride
OPENEYE Name: 2,4-dimethyl-3H-1,5-benzodiazepine hydrochloride
IUPAC Name: 2,4-dimethyl-3H-1,5-benzodiazepine hydrochloride
SYSTEMATIC NAME: 2,4-dimethyl-3H-1,5-benzodiazepine hydrochloride
MOLECULAR FORMULA: C11H13ClN2
MOLECULAR WEIGHT: 208.68732
SMILES: CC1=NC2=CC=CC=C2N=C(C1)C.Cl
Structure:
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