CAS RN: 51222-37-8
CAS Name: carbonic acid [4-[2-(dimethylamino)ethoxy]-2-methyl-5-propan-2-ylphenyl] propan-2-yl ester hydrochloride
OPENEYE Name: [4-[2-(dimethylamino)ethoxy]-5-isopropyl-2-methyl-phenyl] isopropyl carbonate hydrochloride
IUPAC Name: [4-[2-(dimethylamino)ethoxy]-2-methyl-5-propan-2-ylphenyl] propan-2-yl carbonate hydrochloride
SYSTEMATIC NAME: [4-[2-(dimethylamino)ethoxy]-2-methyl-5-propan-2-yl-phenyl] propan-2-yl carbonate hydrochloride
MOLECULAR FORMULA: C18H30ClNO4
MOLECULAR WEIGHT: 359.8881
SMILES: CC1=CC(=C(C=C1OC(=O)OC(C)C)C(C)C)OCCN(C)C.Cl
Structure:
CAS RN: 16624-40-1
CAS Name: (2S)-2-amino-3-(4-hydroxy-3-iodanylphenyl)propanoic acid
OPENEYE Name: (2S)-2-amino-3-(4-hydroxy-3-iodanyl-phenyl)propanoic acid
IUPAC Name: (2S)-2-amino-3-(4-hydroxy-3-iodanylphenyl)propanoic acid
SYSTEMATIC NAME: (2S)-2-azanyl-3-(3-iodanyl-4-oxidanyl-phenyl)propanoic acid
MOLECULAR FORMULA: C9H10INO3
MOLECULAR WEIGHT: 311.086724
SMILES: C1=CC(=C(C=C1C[C@@H](C(=O)O)N)[131I])O
Structure:
CAS RN: 1456-52-6
CAS Name: 3-[3-[acetyl(ethyl)amino]-2,4,6-triiodophenyl]propanoic acid
OPENEYE Name: 3-[3-[acetyl(ethyl)amino]-2,4,6-triiodo-phenyl]propanoic acid
IUPAC Name: 3-[3-[acetyl(ethyl)amino]-2,4,6-triiodophenyl]propanoic acid
SYSTEMATIC NAME: 3-[3-[ethanoyl(ethyl)amino]-2,4,6-tris(iodanyl)phenyl]propanoic acid
MOLECULAR FORMULA: C13H14I3NO3
MOLECULAR WEIGHT: 612.96857
SMILES: CCN(C1=C(C=C(C(=C1I)CCC(=O)O)I)I)C(=O)C
Structure:
CAS RN: 74855-17-7
CAS Name: 15-(4-iodanylphenyl)pentadecanoic acid
OPENEYE Name: 15-(4-iodanylphenyl)pentadecanoic acid
IUPAC Name: 15-(4-iodanylphenyl)pentadecanoic acid
SYSTEMATIC NAME: 15-(4-iodanylphenyl)pentadecanoic acid
MOLECULAR FORMULA: C21H33IO2
MOLECULAR WEIGHT: 440.391118
SMILES: C1=CC(=CC=C1CCCCCCCCCCCCCCC(=O)O)[123I]
Structure:
CAS RN: 86710-23-8
CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-ethylimidazole hydrochloride
OPENEYE Name: 2-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-ethyl-imidazole hydrochloride
IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-ethylimidazole hydrochloride
SYSTEMATIC NAME: 2-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-ethyl-imidazole hydrochloride
MOLECULAR FORMULA: C14H17ClN2O2
MOLECULAR WEIGHT: 280.74998
SMILES: CCN1C=CN=C1CC2COC3=CC=CC=C3O2.Cl
Structure:
CAS RN: 23256-28-2
CAS Name: 4-(6,7-dimethoxy-4-quinazolinyl)-1-piperazinecarboxylic acid (2-hydroxy-2-methylpropyl) ester hydrochloride
OPENEYE Name: (2-hydroxy-2-methyl-propyl) 4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxylate hydrochloride
IUPAC Name: (2-hydroxy-2-methylpropyl) 4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxylate hydrochloride
SYSTEMATIC NAME: (2-methyl-2-oxidanyl-propyl) 4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxylate hydrochloride
MOLECULAR FORMULA: C19H27ClN4O5
MOLECULAR WEIGHT: 426.89448
SMILES: CC(C)(COC(=O)N1CCN(CC1)C2=NC=NC3=CC(=C(C=C32)OC)OC)O.Cl
Structure:
CAS RN: 72060-05-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H29NO3
MOLECULAR WEIGHT: 367.48126
SMILES: CC[C@H]1CC(=O)[C@H]2[C@@]34[C@@H]1C(CC5=C3C(=C(C=C5)OC)O2)N(CC4)CC6CC6
Structure:
CAS RN: 72055-62-0
CAS Name: (2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-imino-3-methyl-9-purinyl)oxolane-3,4-diol
OPENEYE Name: (2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-imino-3-methyl-purin-9-yl)tetrahydrofuran-3,4-diol
IUPAC Name: (2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-imino-3-methylpurin-9-yl)oxolane-3,4-diol
SYSTEMATIC NAME: (2R,3R,4S,5R)-2-(6-azanylidene-3-methyl-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
MOLECULAR FORMULA: C11H15N5O4
MOLECULAR WEIGHT: 281.2679
SMILES: CN1C=NC(=N)C2=C1N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O
Structure:
CAS RN: 72033-27-3
CAS Name: 2-propanol; 2-propenamide
OPENEYE Name: propan-2-ol; prop-2-enamide
IUPAC Name: propan-2-ol; prop-2-enamide
SYSTEMATIC NAME: propan-2-ol; prop-2-enamide
MOLECULAR FORMULA: C6H13NO2
MOLECULAR WEIGHT: 131.17292
SMILES: CC(C)O.C=CC(=O)N
Structure:
CAS RN: 72018-29-2
CAS Name: calcium eicosyl sulfate
OPENEYE Name: calcium icosyl sulfate
IUPAC Name: calcium icosyl sulfate
SYSTEMATIC NAME: calcium icosyl sulfate
MOLECULAR FORMULA: C40H82CaO8S2
MOLECULAR WEIGHT: 795.28228
SMILES: CCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[Ca+2]
Structure:
CAS RN: 72018-28-1
CAS Name: calcium tridecyl sulfate
OPENEYE Name: calcium tridecyl sulfate
IUPAC Name: calcium tridecyl sulfate
SYSTEMATIC NAME: calcium tridecyl sulfate
MOLECULAR FORMULA: C26H54CaO8S2
MOLECULAR WEIGHT: 598.91016
SMILES: CCCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCCOS(=O)(=O)[O-].[Ca+2]
Structure:
CAS RN: 72018-27-0
CAS Name: magnesium hexyl sulfate
OPENEYE Name: magnesium hexyl sulfate
IUPAC Name: magnesium hexyl sulfate
SYSTEMATIC NAME: magnesium hexyl sulfate
MOLECULAR FORMULA: C12H26MgO8S2
MOLECULAR WEIGHT: 386.76504
SMILES: CCCCCCOS(=O)(=O)[O-].CCCCCCOS(=O)(=O)[O-].[Mg+2]
Structure:
CAS RN: 72018-25-8
CAS Name: calcium docosyl sulfate
OPENEYE Name: calcium docosyl sulfate
IUPAC Name: calcium docosyl sulfate
SYSTEMATIC NAME: calcium docosyl sulfate
MOLECULAR FORMULA: C44H90CaO8S2
MOLECULAR WEIGHT: 851.3886
SMILES: CCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[Ca+2]
Structure:
CAS RN: 72018-23-6
CAS Name: magnesium docosyl sulfate
OPENEYE Name: magnesium docosyl sulfate
IUPAC Name: magnesium docosyl sulfate
SYSTEMATIC NAME: magnesium docosyl sulfate
MOLECULAR FORMULA: C44H90MgO8S2
MOLECULAR WEIGHT: 835.6156
SMILES: CCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[Mg+2]
Structure:
CAS RN: 72018-22-5
CAS Name: magnesium eicosyl sulfate
OPENEYE Name: magnesium icosyl sulfate
IUPAC Name: magnesium icosyl sulfate
SYSTEMATIC NAME: magnesium icosyl sulfate
MOLECULAR FORMULA: C40H82MgO8S2
MOLECULAR WEIGHT: 779.50928
SMILES: CCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[Mg+2]
Structure:
CAS RN: 72018-21-4
CAS Name: ammonium eicosyl sulfate
OPENEYE Name: ammonium icosyl sulfate
IUPAC Name: azanium icosyl sulfate
SYSTEMATIC NAME: azanium icosyl sulfate
MOLECULAR FORMULA: C20H45NO4S
MOLECULAR WEIGHT: 395.6406
SMILES: CCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[NH4+]
Structure:
CAS RN: 72018-09-8
CAS Name: 5,5-dimethyl-2-(2,4,6-trimethylphenoxy)-1,3,2$l^{5}-dioxaphosphorinane 2-oxide
OPENEYE Name: 5,5-dimethyl-2-(2,4,6-trimethylphenoxy)-1,3,2$l^{5}-dioxaphosphinane 2-oxide
IUPAC Name: 5,5-dimethyl-2-(2,4,6-trimethylphenoxy)-1,3,2$l^{5}-dioxaphosphinane 2-oxide
SYSTEMATIC NAME: 5,5-dimethyl-2-(2,4,6-trimethylphenoxy)-1,3,2$l^{5}-dioxaphosphinane 2-oxide
MOLECULAR FORMULA: C14H21O4P
MOLECULAR WEIGHT: 284.287901
SMILES: CC1=CC(=C(C(=C1)C)OP2(=O)OCC(CO2)(C)C)C
Structure:
CAS RN: 72018-04-3
CAS Name: 5,5-dimethyl-2-(2,4,6-trimethylphenoxy)-1,3,2-dioxaphosphorinane
OPENEYE Name: 5,5-dimethyl-2-(2,4,6-trimethylphenoxy)-1,3,2-dioxaphosphinane
IUPAC Name: 5,5-dimethyl-2-(2,4,6-trimethylphenoxy)-1,3,2-dioxaphosphinane
SYSTEMATIC NAME: 5,5-dimethyl-2-(2,4,6-trimethylphenoxy)-1,3,2-dioxaphosphinane
MOLECULAR FORMULA: C14H21O3P
MOLECULAR WEIGHT: 268.288501
SMILES: CC1=CC(=C(C(=C1)C)OP2OCC(CO2)(C)C)C
Structure:
CAS RN: 72018-03-2
CAS Name: 2-[2-tert-butyl-4-[1-[5-tert-butyl-4-[(5,5-dimethyl-1,3,2-dioxaphosphorinan-2-yl)oxy]-2-methylphenyl]butyl]-5-methylphenoxy]-5,5-dimethyl-1,3,2-dioxaphosphorinane
OPENEYE Name: 2-[2-tert-butyl-4-[1-[5-tert-butyl-4-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]-2-methyl-phenyl]butyl]-5-methyl-phenoxy]-5,5-dimethyl-1,3,2-dioxaphosphinane
IUPAC Name: 2-[2-tert-butyl-4-[1-[5-tert-butyl-4-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]-2-methylphenyl]butyl]-5-methylphenoxy]-5,5-dimethyl-1,3,2-dioxaphosphinane
SYSTEMATIC NAME: 2-[2-tert-butyl-4-[1-[5-tert-butyl-4-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]-2-methyl-phenyl]butyl]-5-methyl-phenoxy]-5,5-dimethyl-1,3,2-dioxaphosphinane
MOLECULAR FORMULA: C36H56O6P2
MOLECULAR WEIGHT: 646.773762
SMILES: CCCC(C1=CC(=C(C=C1C)OP2OCC(CO2)(C)C)C(C)(C)C)C3=CC(=C(C=C3C)OP4OCC(CO4)(C)C)C(C)(C)C
Structure:
CAS RN: 72018-01-0
CAS Name: benzene-1,3-dicarboxylic acid; 2,2-dimethylpropane-1,3-diol; hexanedioic acid; 2,2,4-trimethylpentane-1,3-diol
OPENEYE Name: adipic acid; 2,2-dimethylpropane-1,3-diol; isophthalic acid; 2,2,4-trimethylpentane-1,3-diol
IUPAC Name: benzene-1,3-dicarboxylic acid; 2,2-dimethylpropane-1,3-diol; hexanedioic acid; 2,2,4-trimethylpentane-1,3-diol
SYSTEMATIC NAME: benzene-1,3-dicarboxylic acid; 2,2-dimethylpropane-1,3-diol; hexanedioic acid; 2,2,4-trimethylpentane-1,3-diol
MOLECULAR FORMULA: C27H46O12
MOLECULAR WEIGHT: 562.64694
SMILES: CC(C)C(C(C)(C)CO)O.CC(C)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCC(=O)O)CC(=O)O
Structure:
CAS RN: 72012-09-0
CAS Name: (8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-(1-oxoprop-2-ynyl)-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
OPENEYE Name: (8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-prop-2-ynoyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
IUPAC Name: (8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-prop-2-ynoyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
SYSTEMATIC NAME: (8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-prop-2-ynoyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
MOLECULAR FORMULA: C22H28O2
MOLECULAR WEIGHT: 324.45652
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)C#C)CCC4=CC(=O)CC[C@]34C
Structure:
CAS RN: 72012-08-9
CAS Name: (8S,9S,10R,13S,14S,17S)-17-[(1R)-1-hydroxyprop-2-ynyl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
OPENEYE Name: (8S,9S,10R,13S,14S,17S)-17-[(1R)-1-hydroxyprop-2-ynyl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
IUPAC Name: (8S,9S,10R,13S,14S,17S)-17-[(1R)-1-hydroxyprop-2-ynyl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
SYSTEMATIC NAME: (8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-[(1R)-1-oxidanylprop-2-ynyl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
MOLECULAR FORMULA: C22H30O2
MOLECULAR WEIGHT: 326.4724
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2[C@H](C#C)O)CCC4=CC(=O)CC[C@]34C
Structure:
CAS RN: 72010-87-8
CAS Name: N-[5-[bis(2-butoxyethyl)amino]-2-[(5-nitro-2-thiazolyl)azo]phenyl]acetamide
OPENEYE Name: N-[5-[bis(2-butoxyethyl)amino]-2-(5-nitrothiazol-2-yl)azo-phenyl]acetamide
IUPAC Name: N-[5-[bis(2-butoxyethyl)amino]-2-[(5-nitro-1,3-thiazol-2-yl)diazenyl]phenyl]acetamide
SYSTEMATIC NAME: N-[5-[bis(2-butoxyethyl)amino]-2-[(5-nitro-1,3-thiazol-2-yl)diazenyl]phenyl]ethanamide
MOLECULAR FORMULA: C23H34N6O5S
MOLECULAR WEIGHT: 506.61826
SMILES: CCCCOCCN(CCOCCCC)C1=CC(=C(C=C1)N=NC2=NC=C(S2)[N+](=O)[O-])NC(=O)C
Structure:
CAS RN: 71998-53-3
CAS Name: 2-[2-(3-azabicyclo[3.2.2]nonan-3-yl)ethyl]-5,6-dimethoxy-1,2-benzothiazol-3-one
OPENEYE Name: 2-[2-(3-azabicyclo[3.2.2]nonan-3-yl)ethyl]-5,6-dimethoxy-1,2-benzothiazol-3-one
IUPAC Name: 2-[2-(3-azabicyclo[3.2.2]nonan-3-yl)ethyl]-5,6-dimethoxy-1,2-benzothiazol-3-one
SYSTEMATIC NAME: 2-[2-(3-azabicyclo[3.2.2]nonan-3-yl)ethyl]-5,6-dimethoxy-1,2-benzothiazol-3-one
MOLECULAR FORMULA: C19H26N2O3S
MOLECULAR WEIGHT: 362.48634
SMILES: COC1=C(C=C2C(=C1)C(=O)N(S2)CCN3CC4CCC(C3)CC4)OC
Structure:
CAS RN: 71982-66-6
CAS Name: 3-(tetradecylthio)propanoic acid [2-tert-butyl-4-[[5-tert-butyl-2-methyl-4-[1-oxo-3-(tetradecylthio)propoxy]phenyl]thio]-5-methylphenyl] ester
OPENEYE Name: [2-tert-butyl-4-[5-tert-butyl-2-methyl-4-(3-tetradecylsulfanylpropanoyloxy)phenyl]sulfanyl-5-methyl-phenyl] 3-tetradecylsulfanylpropanoate
IUPAC Name: [2-tert-butyl-4-[5-tert-butyl-2-methyl-4-(3-tetradecylsulfanylpropanoyloxy)phenyl]sulfanyl-5-methylphenyl] 3-tetradecylsulfanylpropanoate
SYSTEMATIC NAME: [2-tert-butyl-4-[5-tert-butyl-2-methyl-4-(3-tetradecylsulfanylpropanoyloxy)phenyl]sulfanyl-5-methyl-phenyl] 3-tetradecylsulfanylpropanoate
MOLECULAR FORMULA: C56H94O4S3
MOLECULAR WEIGHT: 927.53816
SMILES: CCCCCCCCCCCCCCSCCC(=O)OC1=C(C=C(C(=C1)C)SC2=CC(=C(C=C2C)OC(=O)CCSCCCCCCCCCCCCCC)C(C)(C)C)C(C)(C)C
Structure:
CAS RN: 71965-26-9
CAS Name: 2-methyl-1-(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)-1-cyclohexanol
OPENEYE Name: 2-methyl-1-(1,7,7-trimethylnorbornan-2-yl)cyclohexanol
IUPAC Name: 2-methyl-1-(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)cyclohexan-1-ol
SYSTEMATIC NAME: 2-methyl-1-(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)cyclohexan-1-ol
MOLECULAR FORMULA: C17H30O
MOLECULAR WEIGHT: 250.4195
SMILES: CC1CCCCC1(C2CC3CCC2(C3(C)C)C)O
Structure:
CAS RN: 71965-16-7
CAS Name: titanium(4+); 1-tridecanolate
OPENEYE Name: titanium(4+); tridecan-1-olate
IUPAC Name: titanium(4+); tridecan-1-olate
SYSTEMATIC NAME: titanium(4+); tridecan-1-olate
MOLECULAR FORMULA: C52H108O4Ti
MOLECULAR WEIGHT: 845.27852
SMILES: CCCCCCCCCCCCC[O-].CCCCCCCCCCCCC[O-].CCCCCCCCCCCCC[O-].CCCCCCCCCCCCC[O-].[Ti+4]
Structure:
CAS RN: 71902-28-8
CAS Name: 4-(5-chloro-2-oxido-4-sulfamoylphenyl)azo-5-methyl-2-phenyl-3-pyrazololate; chromium(3+); hexane-1,6-diamine; hydron
OPENEYE Name: chromic; 4-(5-chloro-2-oxido-4-sulfamoyl-phenyl)azo-5-methyl-2-phenyl-pyrazol-3-olate; hexane-1,6-diamine; hydron
IUPAC Name: 4-[(5-chloro-2-oxido-4-sulfamoylphenyl)diazenyl]-5-methyl-2-phenylpyrazol-3-olate; chromium(3+); hexane-1,6-diamine; hydron
SYSTEMATIC NAME: 4-[(5-chloranyl-2-oxidanidyl-4-sulfamoyl-phenyl)diazenyl]-5-methyl-2-phenyl-pyrazol-3-olate; chromium(3+); hexane-1,6-diamine; hydron
MOLECULAR FORMULA: C38H41Cl2CrN12O8S2
MOLECULAR WEIGHT: 980.83984
SMILES: [H+].CC1=NN(C(=C1N=NC2=CC(=C(C=C2[O-])S(=O)(=O)N)Cl)[O-])C3=CC=CC=C3.CC1=NN(C(=C1N=NC2=CC(=C(C=C2[O-])S(=O)(=O)N)Cl)[O-])C3=CC=CC=C3.C(CCCN)CCN.[Cr+3]
Structure:
CAS RN: 71902-01-7
CAS Name: 16-methylheptadecanoic acid; (2S,3R,4S)-pentane-1,1,2,3,4,5-hexol
OPENEYE Name: 16-methylheptadecanoic acid; (2S,3R,4S)-pentane-1,1,2,3,4,5-hexol
IUPAC Name: 16-methylheptadecanoic acid; (2S,3R,4S)-pentane-1,1,2,3,4,5-hexol
SYSTEMATIC NAME: 16-methylheptadecanoic acid; (2S,3R,4S)-pentane-1,1,2,3,4,5-hexol
MOLECULAR FORMULA: C23H48O8
MOLECULAR WEIGHT: 452.62242
SMILES: CC(C)CCCCCCCCCCCCCCC(=O)O.C([C@@H]([C@H]([C@@H](C(O)O)O)O)O)O
Structure:
CAS RN: 851959-14-3
CAS Name: 16-methylheptadecanoic acid; (2S,3R,4S)-pentane-1,1,2,3,4,5-hexol
OPENEYE Name: 16-methylheptadecanoic acid; (2S,3R,4S)-pentane-1,1,2,3,4,5-hexol
IUPAC Name: 16-methylheptadecanoic acid; (2S,3R,4S)-pentane-1,1,2,3,4,5-hexol
SYSTEMATIC NAME: 16-methylheptadecanoic acid; (2S,3R,4S)-pentane-1,1,2,3,4,5-hexol
MOLECULAR FORMULA: C23H48O8
MOLECULAR WEIGHT: 452.62242
SMILES: CC(C)CCCCCCCCCCCCCCC(=O)O.C([C@@H]([C@H]([C@@H](C(O)O)O)O)O)O
Structure:
CAS RN: 71889-21-9
CAS Name: chromium(3+); hexane-1,6-diamine; hydron; 4-[(3-methyl-5-oxido-1-phenyl-4-pyrazolyl)azo]-3-oxido-1-naphthalenesulfonate
OPENEYE Name: chromic; hexane-1,6-diamine; hydron; 4-(3-methyl-5-oxido-1-phenyl-pyrazol-4-yl)azo-3-oxido-naphthalene-1-sulfonate
IUPAC Name: chromium(3+); hexane-1,6-diamine; hydron; 4-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-3-oxidonaphthalene-1-sulfonate
SYSTEMATIC NAME: chromium(3+); hexane-1,6-diamine; hydron; 4-[(3-methyl-5-oxidanidyl-1-phenyl-pyrazol-4-yl)diazenyl]-3-oxidanidyl-naphthalene-1-sulfonate
MOLECULAR FORMULA: C46H45CrN10O10S2
MOLECULAR WEIGHT: 1014.0366
SMILES: [H+].[H+].[H+].CC1=NN(C(=C1N=NC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)[O-])[O-])[O-])C4=CC=CC=C4.CC1=NN(C(=C1N=NC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)[O-])[O-])[O-])C4=CC=CC=C4.C(CCCN)CCN.[Cr+3]
Structure:
CAS RN: 71889-02-6
CAS Name: dioxosilane; trichloro(octadecyl)silane
OPENEYE Name: dioxosilane; trichloro(octadecyl)silane
IUPAC Name: dioxosilane; trichloro(octadecyl)silane
SYSTEMATIC NAME: bis(oxidanylidene)silane; tris(chloranyl)-octadecyl-silane
MOLECULAR FORMULA: C18H37Cl3O2Si2
MOLECULAR WEIGHT: 448.01518
SMILES: CCCCCCCCCCCCCCCCCC[Si](Cl)(Cl)Cl.O=[Si]=O
Structure:
CAS RN: 71889-01-5
CAS Name: chloro(trimethyl)silane; dioxosilane
OPENEYE Name: chloro(trimethyl)silane; dioxosilane
IUPAC Name: chloro(trimethyl)silane; dioxosilane
SYSTEMATIC NAME: bis(oxidanylidene)silane; chloranyl(trimethyl)silane
MOLECULAR FORMULA: C3H9ClO2Si2
MOLECULAR WEIGHT: 168.72636
SMILES: C[Si](C)(C)Cl.O=[Si]=O
Structure:
CAS RN: 71888-97-6
CAS Name: dioxosilane; 3-triethoxysilyl-1-propanamine
OPENEYE Name: dioxosilane; 3-triethoxysilylpropan-1-amine
IUPAC Name: dioxosilane; 3-triethoxysilylpropan-1-amine
SYSTEMATIC NAME: bis(oxidanylidene)silane; 3-triethoxysilylpropan-1-amine
MOLECULAR FORMULA: C9H23NO5Si2
MOLECULAR WEIGHT: 281.45362
SMILES: CCO[Si](CCCN)(OCC)OCC.O=[Si]=O
Structure:
CAS RN: 93028-53-6
CAS Name: dioxosilane; 3-triethoxysilyl-1-propanamine
OPENEYE Name: dioxosilane; 3-triethoxysilylpropan-1-amine
IUPAC Name: dioxosilane; 3-triethoxysilylpropan-1-amine
SYSTEMATIC NAME: bis(oxidanylidene)silane; 3-triethoxysilylpropan-1-amine
MOLECULAR FORMULA: C9H23NO5Si2
MOLECULAR WEIGHT: 281.45362
SMILES: CCO[Si](CCCN)(OCC)OCC.O=[Si]=O
Structure:
CAS RN: 71888-82-9
CAS Name: 4-[(4-anilino-5-sulfo-1-naphthalenyl)azo]-5-hydroxynaphthalene-2,7-disulfonic acid; guanidine
OPENEYE Name: 4-[(4-anilino-5-sulfo-1-naphthyl)azo]-5-hydroxy-naphthalene-2,7-disulfonic acid; guanidine
IUPAC Name: 4-[(4-anilino-5-sulfonaphthalen-1-yl)diazenyl]-5-hydroxynaphthalene-2,7-disulfonic acid; guanidine
SYSTEMATIC NAME: guanidine; 4-oxidanyl-5-[(4-phenylazanyl-5-sulfo-naphthalen-1-yl)diazenyl]naphthalene-2,7-disulfonic acid
MOLECULAR FORMULA: C29H34N12O10S3
MOLECULAR WEIGHT: 806.84966
SMILES: C1=CC=C(C=C1)NC2=C3C(=C(C=C2)N=NC4=C5C(=CC(=C4)S(=O)(=O)O)C=C(C=C5O)S(=O)(=O)O)C=CC=C3S(=O)(=O)O.C(=N)(N)N.C(=N)(N)N.C(=N)(N)N
Structure:
CAS RN: 71888-70-5
CAS Name: 12,21,27-tris(2-aminoethyl)-24,31-di(butan-2-yl)-3-(hydroxymethyl)-6,15-bis(2-methylpropyl)-18-(phenylmethyl)-9-propan-2-yl-1-oxa-4,7,10,13,16,19,22,25,28-nonazacyclohentriacontane-2,5,8,11,14,17,20,23,26,29-decone
OPENEYE Name: 12,21,27-tris(2-aminoethyl)-18-benzyl-3-(hydroxymethyl)-6,15-diisobutyl-9-isopropyl-24,31-disec-butyl-1-oxa-4,7,10,13,16,19,22,25,28-nonazacyclohentriacontane-2,5,8,11,14,17,20,23,26,29-decone
IUPAC Name: 12,21,27-tris(2-aminoethyl)-18-benzyl-24,31-di(butan-2-yl)-3-(hydroxymethyl)-6,15-bis(2-methylpropyl)-9-propan-2-yl-1-oxa-4,7,10,13,16,19,22,25,28-nonazacyclohentriacontane-2,5,8,11,14,17,20,23,26,29-decone
SYSTEMATIC NAME: 12,21,27-tris(2-azanylethyl)-24,31-di(butan-2-yl)-3-(hydroxymethyl)-6,15-bis(2-methylpropyl)-18-(phenylmethyl)-9-propan-2-yl-1-oxa-4,7,10,13,16,19,22,25,28-nonazacyclohentriacontane-2,5,8,11,14,17,20,23,26,29-decone
MOLECULAR FORMULA: C54H92N12O12
MOLECULAR WEIGHT: 1101.38148
SMILES: CCC(C)C1CC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)O1)CO)CC(C)C)C(C)C)CCN)CC(C)C)CC2=CC=CC=C2)CCN)C(C)CC)CCN
Structure:
CAS RN: 71873-55-7
CAS Name: 2-[N-ethyl-3-methyl-4-[(3-phenyl-1,2,4-thiadiazol-5-yl)azo]anilino]ethyl-trimethylammonium sulfate
OPENEYE Name: 2-[N-ethyl-3-methyl-4-[(3-phenyl-1,2,4-thiadiazol-5-yl)azo]anilino]ethyl-trimethyl-ammonium sulfate
IUPAC Name: 2-[N-ethyl-3-methyl-4-[(3-phenyl-1,2,4-thiadiazol-5-yl)diazenyl]anilino]ethyl-trimethylazanium sulfate
SYSTEMATIC NAME: 2-[ethyl-[3-methyl-4-[(3-phenyl-1,2,4-thiadiazol-5-yl)diazenyl]phenyl]amino]ethyl-trimethyl-azanium sulfate
MOLECULAR FORMULA: C22H29N6O4S2-
MOLECULAR WEIGHT: 505.63346
SMILES: CCN(CC[N+](C)(C)C)C1=CC(=C(C=C1)N=NC2=NC(=NS2)C3=CC=CC=C3)C.[O-]S(=O)(=O)[O-]
Structure:
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