CAS RN: 69140-64-3
CAS Name: 2-(6-methylheptoxy)-2-oxoethanethiolate; platinum(2+); chloride
OPENEYE Name: 2-(6-methylheptoxy)-2-oxo-ethanethiolate; platinum(2+); chloride
IUPAC Name: 2-(6-methylheptoxy)-2-oxoethanethiolate; platinum(2+); chloride
SYSTEMATIC NAME: 2-(6-methylheptoxy)-2-oxidanylidene-ethanethiolate; platinum(2+); chloride
MOLECULAR FORMULA: C10H19ClO2PtS
MOLECULAR WEIGHT: 433.85266
SMILES: CC(C)CCCCCOC(=O)C[S-].[Cl-].[Pt+2]
Structure:
CAS RN: 69136-73-8
CAS Name: 6-chloro-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide; 1-(1-naphthalenyloxy)-3-(propan-2-ylamino)-2-propanol
OPENEYE Name: 6-chloro-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide; 1-(isopropylamino)-3-(1-naphthyloxy)propan-2-ol
IUPAC Name: 6-chloro-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide; 1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-ol
SYSTEMATIC NAME: 6-chloranyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide; 1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-ol
MOLECULAR FORMULA: C23H29ClN4O6S2
MOLECULAR WEIGHT: 557.08256
SMILES: CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O.C1NC2=CC(=C(C=C2S(=O)(=O)N1)S(=O)(=O)N)Cl
Structure:
CAS RN: 69123-93-9
CAS Name: 4-amino-5-bromo-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-pyrimidinone
OPENEYE Name: 4-amino-5-bromo-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2-one
IUPAC Name: 4-amino-5-bromo-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
SYSTEMATIC NAME: 4-azanyl-5-bromanyl-1-[(2R,3S,4R,5R)-3-fluoranyl-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]pyrimidin-2-one
MOLECULAR FORMULA: C9H11BrFN3O4
MOLECULAR WEIGHT: 324.103743
SMILES: C1=C(C(=NC(=O)N1[C@H]2[C@H]([C@@H]([C@H](O2)CO)O)F)N)Br
Structure:
CAS RN: 69123-92-8
CAS Name: 4-amino-5-chloro-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-pyrimidinone
OPENEYE Name: 4-amino-5-chloro-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2-one
IUPAC Name: 4-amino-5-chloro-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
SYSTEMATIC NAME: 4-azanyl-5-chloranyl-1-[(2R,3S,4R,5R)-3-fluoranyl-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]pyrimidin-2-one
MOLECULAR FORMULA: C9H11ClFN3O4
MOLECULAR WEIGHT: 279.652743
SMILES: C1=C(C(=NC(=O)N1[C@H]2[C@H]([C@@H]([C@H](O2)CO)O)F)N)Cl
Structure:
CAS RN: 69121-24-0
CAS Name: copper trisodium 3-[3-[(5-chloro-2,6-difluoro-4-pyrimidinyl)amino]-2-oxido-5-sulfonatophenyl]azo-4-oxidonaphthalene-2,7-disulfonate
OPENEYE Name: copper trisodium 3-[3-[(5-chloro-2,6-difluoro-pyrimidin-4-yl)amino]-2-oxido-5-sulfonato-phenyl]azo-4-oxido-naphthalene-2,7-disulfonate
IUPAC Name: copper trisodium 3-[[3-[(5-chloro-2,6-difluoropyrimidin-4-yl)amino]-2-oxido-5-sulfonatophenyl]diazenyl]-4-oxidonaphthalene-2,7-disulfonate
SYSTEMATIC NAME: copper trisodium 3-[[3-[[5-chloranyl-2,6-bis(fluoranyl)pyrimidin-4-yl]amino]-2-oxidanidyl-5-sulfonato-phenyl]diazenyl]-4-oxidanidyl-naphthalene-2,7-disulfonate
MOLECULAR FORMULA: C20H7ClCuF2N5Na3O11S3
MOLECULAR WEIGHT: 795.456596
SMILES: C1=CC2=C(C(=C(C=C2C=C1S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC3=CC(=CC(=C3[O-])NC4=C(C(=NC(=N4)F)F)Cl)S(=O)(=O)[O-])[O-].[Na+].[Na+].[Na+].[Cu+2]
Structure:
CAS RN: 69089-42-5
CAS Name: dimethyl-[3-(trimethylammonio)propyl]-[3-(2,3,3-trimethyldecan-2-yloxy)propyl]ammonium dichloride
OPENEYE Name: dimethyl-[3-(1,1,2,2-tetramethylnonoxy)propyl]-[3-(trimethylammonio)propyl]ammonium dichloride
IUPAC Name: dimethyl-[3-(trimethylazaniumyl)propyl]-[3-(2,3,3-trimethyldecan-2-yloxy)propyl]azanium dichloride
SYSTEMATIC NAME: dimethyl-[3-(trimethylazaniumyl)propyl]-[3-(2,3,3-trimethyldecan-2-yloxy)propyl]azanium dichloride
MOLECULAR FORMULA: C24H54Cl2N2O
MOLECULAR WEIGHT: 457.60436
SMILES: CCCCCCCC(C)(C)C(C)(C)OCCC[N+](C)(C)CCC[N+](C)(C)C.[Cl-].[Cl-]
Structure:
CAS RN: 69013-35-0
CAS Name: disodium 5-[[4-chloro-6-(3-phosphonoanilino)-1,3,5-triazin-2-yl]amino]-2-[[8-[ethyl-[(3-sulfonatophenyl)methyl]amino]-10-(4-methoxy-3-sulfonatophenyl)-2-phenazin-10-iumyl]amino]benzenesulfonate
OPENEYE Name: disodium 5-[[4-chloro-6-(3-phosphonoanilino)-1,3,5-triazin-2-yl]amino]-2-[[8-[ethyl-[(3-sulfonatophenyl)methyl]amino]-10-(4-methoxy-3-sulfonato-phenyl)phenazin-10-ium-2-yl]amino]benzenesulfonate
IUPAC Name: disodium 5-[[4-chloro-6-(3-phosphonoanilino)-1,3,5-triazin-2-yl]amino]-2-[[8-[ethyl-[(3-sulfonatophenyl)methyl]amino]-10-(4-methoxy-3-sulfonatophenyl)phenazin-10-ium-2-yl]amino]benzenesulfonate
SYSTEMATIC NAME: disodium 5-[[4-chloranyl-6-[(3-phosphonophenyl)amino]-1,3,5-triazin-2-yl]amino]-2-[[8-[ethyl-[(3-sulfonatophenyl)methyl]amino]-10-(4-methoxy-3-sulfonato-phenyl)phenazin-10-ium-2-yl]amino]benzenesulfonate
MOLECULAR FORMULA: C43H35ClN9Na2O13PS3
MOLECULAR WEIGHT: 1094.391801
SMILES: CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC3=[N+](C4=C(C=CC(=C4)NC5=C(C=C(C=C5)NC6=NC(=NC(=N6)NC7=CC(=CC=C7)P(=O)(O)O)Cl)S(=O)(=O)[O-])N=C3C=C2)C8=CC(=C(C=C8)OC)S(=O)(=O)[O-].[Na+].[Na+]
Structure:
CAS RN: 69011-81-0
CAS Name: 1H-imidazole; 2-methyl-1H-imidazole; 2-methyloxirane
OPENEYE Name: imidazole; 2-methyl-1H-imidazole; 2-methyloxirane
IUPAC Name: 1H-imidazole; 2-methyl-1H-imidazole; 2-methyloxirane
SYSTEMATIC NAME: 1H-imidazole; 2-methyl-1H-imidazole; 2-methyloxirane
MOLECULAR FORMULA: C10H16N4O
MOLECULAR WEIGHT: 208.26024
SMILES: CC1CO1.CC1=NC=CN1.C1=CN=CN1
Structure:
CAS RN: 69011-49-0
CAS Name: dimethylaminomethanol; 2-methyl-2-propenoic acid 2-(2-methyl-1-oxoprop-2-enoxy)ethyl ester; styrene
OPENEYE Name: dimethylaminomethanol; 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate; styrene
IUPAC Name: dimethylaminomethanol; 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate; styrene
SYSTEMATIC NAME: dimethylaminomethanol; ethenylbenzene; 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C21H31NO5
MOLECULAR WEIGHT: 377.47454
SMILES: CC(=C)C(=O)OCCOC(=O)C(=C)C.CN(C)CO.C=CC1=CC=CC=C1
Structure:
CAS RN: 69011-44-5
CAS Name: 2-(dimethylamino)ethanol; 2-methyl-2-propenoic acid 2-(2-methyl-1-oxoprop-2-enoxy)ethyl ester; styrene
OPENEYE Name: 2-(dimethylamino)ethanol; 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate; styrene
IUPAC Name: 2-(dimethylamino)ethanol; 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate; styrene
SYSTEMATIC NAME: 2-(dimethylamino)ethanol; ethenylbenzene; 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C22H33NO5
MOLECULAR WEIGHT: 391.50112
SMILES: CC(=C)C(=O)OCCOC(=O)C(=C)C.CN(C)CCO.C=CC1=CC=CC=C1
Structure:
CAS RN: 69011-39-8
CAS Name: 1,2-bis(ethenyl)benzene; N',N'-dimethylpropane-1,3-diamine; 1-ethenyl-2-ethylbenzene; 2-propenenitrile; 2-propenoic acid methyl ester
OPENEYE Name: N',N'-dimethylpropane-1,3-diamine; 1,2-divinylbenzene; 1-ethyl-2-vinyl-benzene; methyl prop-2-enoate; prop-2-enenitrile
IUPAC Name: 1,2-bis(ethenyl)benzene; N',N'-dimethylpropane-1,3-diamine; 1-ethenyl-2-ethylbenzene; methyl prop-2-enoate; prop-2-enenitrile
SYSTEMATIC NAME: 1,2-bis(ethenyl)benzene; N',N'-dimethylpropane-1,3-diamine; 1-ethenyl-2-ethyl-benzene; methyl prop-2-enoate; prop-2-enenitrile
MOLECULAR FORMULA: C32H45N3O2
MOLECULAR WEIGHT: 503.7186
SMILES: CCC1=CC=CC=C1C=C.CN(C)CCCN.COC(=O)C=C.C=CC#N.C=CC1=CC=CC=C1C=C
Structure:
CAS RN: 69011-32-1
CAS Name: ethane-1,2-diol; hexanedioic acid; 1-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]cyclohexane; 2-propenoic acid 2-hydroxyethyl ester
OPENEYE Name: adipic acid; ethylene glycol; 2-hydroxyethyl prop-2-enoate; 1-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]cyclohexane
IUPAC Name: ethane-1,2-diol; hexanedioic acid; 2-hydroxyethyl prop-2-enoate; 1-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]cyclohexane
SYSTEMATIC NAME: ethane-1,2-diol; hexanedioic acid; 2-hydroxyethyl prop-2-enoate; 1-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]cyclohexane
MOLECULAR FORMULA: C28H46N2O11
MOLECULAR WEIGHT: 586.67164
SMILES: C=CC(=O)OCCO.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CO)O
Structure:
CAS RN: 69011-31-0
CAS Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid; propane-1,2-diol; 2-propenoic acid 2-hydroxyethyl ester
OPENEYE Name: adipic acid; 1,3-diisocyanato-2-methyl-benzene; ethylene glycol; 2-hydroxyethyl prop-2-enoate; propane-1,2-diol
IUPAC Name: 1,3-diisocyanato-2-methylbenzene; ethane-1,2-diol; hexanedioic acid; 2-hydroxyethyl prop-2-enoate; propane-1,2-diol
SYSTEMATIC NAME: 1,3-diisocyanato-2-methyl-benzene; ethane-1,2-diol; hexanedioic acid; 2-hydroxyethyl prop-2-enoate; propane-1,2-diol
MOLECULAR FORMULA: C25H38N2O13
MOLECULAR WEIGHT: 574.57482
SMILES: CC1=C(C=CC=C1N=C=O)N=C=O.CC(CO)O.C=CC(=O)OCCO.C(CCC(=O)O)CC(=O)O.C(CO)O
Structure:
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