CAS RN: 3535-84-0
CAS Name: thallium; thiocyanic acid
OPENEYE Name: thallium; thiocyanic acid
IUPAC Name: thallium; thiocyanic acid
SYSTEMATIC NAME: thallium; thiocyanic acid
MOLECULAR FORMULA: CHNSTl
MOLECULAR WEIGHT: 263.47364
SMILES: C(#N)S.[Tl]
Structure:
CAS RN: 36125-57-2
CAS Name: 5-amino-1-cyclopentyl-N'-phenylmethoxy-4-imidazolecarboximidamide hydrochloride
OPENEYE Name: 5-amino-N'-benzyloxy-1-cyclopentyl-imidazole-4-carboxamidine hydrochloride
IUPAC Name: 5-amino-1-cyclopentyl-N'-phenylmethoxyimidazole-4-carboximidamide hydrochloride
SYSTEMATIC NAME: 5-azanyl-1-cyclopentyl-N'-phenylmethoxy-imidazole-4-carboximidamide hydrochloride
MOLECULAR FORMULA: C16H22ClN5O
MOLECULAR WEIGHT: 335.83178
SMILES: C1CCC(C1)N2C=NC(=C2N)C(=NOCC3=CC=CC=C3)N.Cl
Structure:
CAS RN: 4480-10-8
CAS Name: potassium; 1,1,2,2-tetranitroethane
OPENEYE Name: potassium; 1,1,2,2-tetranitroethane
IUPAC Name: potassium; 1,1,2,2-tetranitroethane
SYSTEMATIC NAME: potassium; 1,1,2,2-tetranitroethane
MOLECULAR FORMULA: C2H2KN4O8
MOLECULAR WEIGHT: 249.15758
SMILES: C(C([N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-].[K]
Structure:
CAS RN: 38448-43-0
CAS Name: 4-methylbenzenesulfonohydrazide; sodium
OPENEYE Name: 4-methylbenzenesulfonohydrazide; sodium
IUPAC Name: 4-methylbenzenesulfonohydrazide; sodium
SYSTEMATIC NAME: 4-methylbenzenesulfonohydrazide; sodium
MOLECULAR FORMULA: C7H10N2NaO2S
MOLECULAR WEIGHT: 209.22127
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NN.[Na]
Structure:
CAS RN: 40154-38-9
CAS Name: 4-methyl-N-[(phenylmethylene)amino]benzenesulfonamide; sodium
OPENEYE Name: N-(benzylideneamino)-4-methyl-benzenesulfonamide; sodium
IUPAC Name: N-(benzylideneamino)-4-methylbenzenesulfonamide; sodium
SYSTEMATIC NAME: 4-methyl-N-[(phenylmethylidene)amino]benzenesulfonamide; sodium
MOLECULAR FORMULA: C14H14N2NaO2S
MOLECULAR WEIGHT: 297.32793
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NN=CC2=CC=CC=C2.[Na]
Structure:
CAS RN: 62302-28-7
CAS Name: 4-piperidinylmethanol hydrochloride
OPENEYE Name: 4-piperidylmethanol hydrochloride
IUPAC Name: piperidin-4-ylmethanol hydrochloride
SYSTEMATIC NAME: piperidin-4-ylmethanol hydrochloride
MOLECULAR FORMULA: C6H14ClNO
MOLECULAR WEIGHT: 151.63446
SMILES: C1CNCCC1CO.Cl
Structure:
CAS RN: 90748-01-9
CAS Name: 4-piperidinylmethanol hydrochloride
OPENEYE Name: 4-piperidylmethanol hydrochloride
IUPAC Name: piperidin-4-ylmethanol hydrochloride
SYSTEMATIC NAME: piperidin-4-ylmethanol hydrochloride
MOLECULAR FORMULA: C6H14ClNO
MOLECULAR WEIGHT: 151.63446
SMILES: C1CNCCC1CO.Cl
Structure:
CAS RN: 60048-18-2
CAS Name: 9-fluorenimine hydrochloride
OPENEYE Name: fluoren-9-imine hydrochloride
IUPAC Name: fluoren-9-imine hydrochloride
SYSTEMATIC NAME: fluoren-9-imine hydrochloride
MOLECULAR FORMULA: C13H10ClN
MOLECULAR WEIGHT: 215.6782
SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3C2=N.Cl
Structure:
CAS RN: 87283-42-9
CAS Name: 3-cyclohexyl-4-methylthiazol-3-ium chloride
OPENEYE Name: 3-cyclohexyl-4-methyl-thiazol-3-ium chloride
IUPAC Name: 3-cyclohexyl-4-methyl-1,3-thiazol-3-ium chloride
SYSTEMATIC NAME: 3-cyclohexyl-4-methyl-1,3-thiazol-3-ium chloride
MOLECULAR FORMULA: C10H16ClNS
MOLECULAR WEIGHT: 217.75874
SMILES: CC1=CSC=[N+]1C2CCCCC2.[Cl-]
Structure:
CAS RN: 811-68-7
CAS Name: silver; trifluoromethanethiol
OPENEYE Name: silver; trifluoromethanethiol
IUPAC Name: silver; trifluoromethanethiol
SYSTEMATIC NAME: silver; tris(fluoranyl)methanethiol
MOLECULAR FORMULA: CHAgF3S
MOLECULAR WEIGHT: 209.94705
SMILES: C(F)(F)(F)S.[Ag]
Structure:
CAS RN: 13356-09-7
CAS Name: tris(2-methyl-2-phenylpropyl)tin
OPENEYE Name: tris(2-methyl-2-phenyl-propyl)tin
IUPAC Name: tris(2-methyl-2-phenylpropyl)tin
SYSTEMATIC NAME: tris(2-methyl-2-phenyl-propyl)tin
MOLECULAR FORMULA: C60H78Sn2
MOLECULAR WEIGHT: 1036.68132
SMILES: CC(C)(C[Sn](CC(C)(C)C1=CC=CC=C1)CC(C)(C)C2=CC=CC=C2)C3=CC=CC=C3.CC(C)(C[Sn](CC(C)(C)C1=CC=CC=C1)CC(C)(C)C2=CC=CC=C2)C3=CC=CC=C3
Structure:
CAS RN: 69781-73-3
CAS Name: 4-aminobenzoic acid 1-(nonan-5-ylamino)propan-2-yl ester hydrochloride
OPENEYE Name: [2-(1-butylpentylamino)-1-methyl-ethyl] 4-aminobenzoate hydrochloride
IUPAC Name: 1-(nonan-5-ylamino)propan-2-yl 4-aminobenzoate hydrochloride
SYSTEMATIC NAME: 1-(nonan-5-ylamino)propan-2-yl 4-azanylbenzoate hydrochloride
MOLECULAR FORMULA: C19H33ClN2O2
MOLECULAR WEIGHT: 356.93052
SMILES: CCCCC(CCCC)NCC(C)OC(=O)C1=CC=C(C=C1)N.Cl
Structure:
CAS RN: 69781-45-9
CAS Name: 4-aminobenzoic acid 1-(4-methylpentan-2-ylamino)propan-2-yl ester hydrochloride
OPENEYE Name: [2-(1,3-dimethylbutylamino)-1-methyl-ethyl] 4-aminobenzoate hydrochloride
IUPAC Name: 1-(4-methylpentan-2-ylamino)propan-2-yl 4-aminobenzoate hydrochloride
SYSTEMATIC NAME: 1-(4-methylpentan-2-ylamino)propan-2-yl 4-azanylbenzoate hydrochloride
MOLECULAR FORMULA: C16H27ClN2O2
MOLECULAR WEIGHT: 314.85078
SMILES: CC(C)CC(C)NCC(C)OC(=O)C1=CC=C(C=C1)N.Cl
Structure:
CAS RN: 66941-97-7
CAS Name: 1,5-diethyl-5-(phenylmethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione; sodium
OPENEYE Name: 5-benzyl-1,5-diethyl-2-thioxo-hexahydropyrimidine-4,6-dione; sodium
IUPAC Name: 5-benzyl-1,5-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione; sodium
SYSTEMATIC NAME: 1,5-diethyl-5-(phenylmethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione; sodium
MOLECULAR FORMULA: C15H18N2NaO2S
MOLECULAR WEIGHT: 313.37039
SMILES: CCC1(C(=O)NC(=S)N(C1=O)CC)CC2=CC=CC=C2.[Na]
Structure:
CAS RN: 67050-10-6
CAS Name: 5-but-2-enyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione; sodium
OPENEYE Name: 5-but-2-enyl-5-isopentyl-hexahydropyrimidine-2,4,6-trione; sodium
IUPAC Name: 5-but-2-enyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione; sodium
SYSTEMATIC NAME: 5-but-2-enyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione; sodium
MOLECULAR FORMULA: C13H20N2NaO3
MOLECULAR WEIGHT: 275.29927
SMILES: CC=CCC1(C(=O)NC(=O)NC1=O)CCC(C)C.[Na]
Structure:
CAS RN: 67049-99-4
CAS Name: 5-butan-2-yl-5-but-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione; sodium
OPENEYE Name: 5-but-2-enyl-5-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-dione; sodium
IUPAC Name: 5-butan-2-yl-5-but-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione; sodium
SYSTEMATIC NAME: 5-butan-2-yl-5-but-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione; sodium
MOLECULAR FORMULA: C12H18N2NaO2S
MOLECULAR WEIGHT: 277.33829
SMILES: CCC(C)C1(C(=O)NC(=S)NC1=O)CC=CC.[Na]
Structure:
CAS RN: 66940-52-1
CAS Name: 5-(1-cyclohexenyl)-1,5-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione; sodium
OPENEYE Name: 5-(cyclohexen-1-yl)-1,5-dimethyl-2-thioxo-hexahydropyrimidine-4,6-dione; sodium
IUPAC Name: 5-(cyclohexen-1-yl)-1,5-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione; sodium
SYSTEMATIC NAME: 5-(cyclohexen-1-yl)-1,5-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione; sodium
MOLECULAR FORMULA: C12H16N2NaO2S
MOLECULAR WEIGHT: 275.32241
SMILES: CC1(C(=O)NC(=S)N(C1=O)C)C2=CCCCC2.[Na]
Structure:
CAS RN: 67050-14-0
CAS Name: 5-but-2-enyl-5-propyl-1,3-diazinane-2,4,6-trione; sodium
OPENEYE Name: 5-but-2-enyl-5-propyl-hexahydropyrimidine-2,4,6-trione; sodium
IUPAC Name: 5-but-2-enyl-5-propyl-1,3-diazinane-2,4,6-trione; sodium
SYSTEMATIC NAME: 5-but-2-enyl-5-propyl-1,3-diazinane-2,4,6-trione; sodium
MOLECULAR FORMULA: C11H16N2NaO3
MOLECULAR WEIGHT: 247.24611
SMILES: CCCC1(C(=O)NC(=O)NC1=O)CC=CC.[Na]
Structure:
CAS RN: 31863-86-2
CAS Name: 1-[4-[(1,2,3,4,7,7-hexachloro-5-bicyclo[2.2.1]hepta-2,5-dienyl)methyl]-4-methyl-1-piperazin-4-iumyl]-1-hexadecanone bromide
OPENEYE Name: 1-[4-[(1,2,3,4,7,7-hexachloro-5-bicyclo[2.2.1]hepta-2,5-dienyl)methyl]-4-methyl-piperazin-4-ium-1-yl]hexadecan-1-one bromide
IUPAC Name: 1-[4-[(1,2,3,4,7,7-hexachloro-5-bicyclo[2.2.1]hepta-2,5-dienyl)methyl]-4-methylpiperazin-4-ium-1-yl]hexadecan-1-one bromide
SYSTEMATIC NAME: 1-[4-[[1,2,3,4,7,7-hexakis(chloranyl)-5-bicyclo[2.2.1]hepta-2,5-dienyl]methyl]-4-methyl-piperazin-4-ium-1-yl]hexadecan-1-one bromide
MOLECULAR FORMULA: C29H45BrCl6N2O
MOLECULAR WEIGHT: 730.3024
SMILES: CCCCCCCCCCCCCCCC(=O)N1CC[N+](CC1)(C)CC2=CC3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl.[Br-]
Structure:
CAS RN: 32706-73-3
CAS Name: diethyl-[2-(1-oxohexadecylamino)ethyl]-prop-2-ynylammonium bromide
OPENEYE Name: diethyl-[2-(hexadecanoylamino)ethyl]-prop-2-ynyl-ammonium bromide
IUPAC Name: diethyl-[2-(hexadecanoylamino)ethyl]-prop-2-ynylazanium bromide
SYSTEMATIC NAME: diethyl-[2-(hexadecanoylamino)ethyl]-prop-2-ynyl-azanium bromide
MOLECULAR FORMULA: C25H49BrN2O
MOLECULAR WEIGHT: 473.57336
SMILES: CCCCCCCCCCCCCCCC(=O)NCC[N+](CC)(CC)CC#C.[Br-]
Structure:
CAS RN: 32706-72-2
CAS Name: diethyl-methyl-[2-(1-oxohexadecylamino)ethyl]ammonium iodide
OPENEYE Name: diethyl-[2-(hexadecanoylamino)ethyl]-methyl-ammonium iodide
IUPAC Name: diethyl-[2-(hexadecanoylamino)ethyl]-methylazanium iodide
SYSTEMATIC NAME: diethyl-[2-(hexadecanoylamino)ethyl]-methyl-azanium iodide
MOLECULAR FORMULA: C23H49IN2O
MOLECULAR WEIGHT: 496.55243
SMILES: CCCCCCCCCCCCCCCC(=O)NCC[N+](C)(CC)CC.[I-]
Structure:
CAS RN: 31863-85-1
CAS Name: trimethyl-[2-(1-oxohexadecylamino)ethyl]ammonium iodide
OPENEYE Name: 2-(hexadecanoylamino)ethyl-trimethyl-ammonium iodide
IUPAC Name: 2-(hexadecanoylamino)ethyl-trimethylazanium iodide
SYSTEMATIC NAME: 2-(hexadecanoylamino)ethyl-trimethyl-azanium iodide
MOLECULAR FORMULA: C21H45IN2O
MOLECULAR WEIGHT: 468.49927
SMILES: CCCCCCCCCCCCCCCC(=O)NCC[N+](C)(C)C.[I-]
Structure:
CAS RN: 31981-06-3
CAS Name: trimethyl-[2-(1-oxodecylamino)ethyl]ammonium iodide
OPENEYE Name: 2-(decanoylamino)ethyl-trimethyl-ammonium iodide
IUPAC Name: 2-(decanoylamino)ethyl-trimethylazanium iodide
SYSTEMATIC NAME: 2-(decanoylamino)ethyl-trimethyl-azanium iodide
MOLECULAR FORMULA: C15H33IN2O
MOLECULAR WEIGHT: 384.33979
SMILES: CCCCCCCCCC(=O)NCC[N+](C)(C)C.[I-]
Structure:
CAS RN: 32705-98-9
CAS Name: 1-(4,4-dimethyl-1-piperazin-4-iumyl)-1-octadecanone iodide
OPENEYE Name: 1-(4,4-dimethylpiperazin-4-ium-1-yl)octadecan-1-one iodide
IUPAC Name: 1-(4,4-dimethylpiperazin-4-ium-1-yl)octadecan-1-one iodide
SYSTEMATIC NAME: 1-(4,4-dimethylpiperazin-4-ium-1-yl)octadecan-1-one iodide
MOLECULAR FORMULA: C24H49IN2O
MOLECULAR WEIGHT: 508.56313
SMILES: CCCCCCCCCCCCCCCCCC(=O)N1CC[N+](CC1)(C)C.[I-]
Structure:
CAS RN: 32706-01-7
CAS Name: 1-(4,4-dimethyl-1-piperazin-4-iumyl)-1-decanone iodide
OPENEYE Name: 1-(4,4-dimethylpiperazin-4-ium-1-yl)decan-1-one iodide
IUPAC Name: 1-(4,4-dimethylpiperazin-4-ium-1-yl)decan-1-one iodide
SYSTEMATIC NAME: 1-(4,4-dimethylpiperazin-4-ium-1-yl)decan-1-one iodide
MOLECULAR FORMULA: C16H33IN2O
MOLECULAR WEIGHT: 396.35049
SMILES: CCCCCCCCCC(=O)N1CC[N+](CC1)(C)C.[I-]
Structure:
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