CAS RN: 93803-19-1
CAS Name: [2-hydroxy-3-(1-oxoeicosylamino)-3-(1-oxooctadecoxy)propyl]-dimethyl-propylammonium chloride
OPENEYE Name: [2-hydroxy-3-(icosanoylamino)-3-octadecanoyloxy-propyl]-dimethyl-propyl-ammonium chloride
IUPAC Name: [2-hydroxy-3-(icosanoylamino)-3-octadecanoyloxypropyl]-dimethyl-propylazanium chloride
SYSTEMATIC NAME: [3-(icosanoylamino)-3-octadecanoyloxy-2-oxidanyl-propyl]-dimethyl-propyl-azanium chloride
MOLECULAR FORMULA: C46H93ClN2O4
MOLECULAR WEIGHT: 773.69462
SMILES: CCCCCCCCCCCCCCCCCCCC(=O)NC(C(C[N+](C)(C)CCC)O)OC(=O)CCCCCCCCCCCCCCCCC.[Cl-]
CAS RN: 72854-09-2
CAS Name: tetrasodium 2-[(E)-2-[4-[oxido-[4-[oxido-(4-sulfonatophenyl)iminoammonio]phenyl]iminoammonio]-2-sulfonatophenyl]ethenyl]-5-[4-[oxido-(4-sulfonatophenyl)iminoammonio]phenyl]azobenzenesulfonate
OPENEYE Name: tetrasodium 2-[(E)-2-[4-[oxido-[4-[oxido-(4-sulfonatophenyl)imino-ammonio]phenyl]imino-ammonio]-2-sulfonato-phenyl]vinyl]-5-[4-[oxido-(4-sulfonatophenyl)imino-ammonio]phenyl]azo-benzenesulfonate
IUPAC Name: tetrasodium 2-[(E)-2-[4-[oxido-[4-[oxido-(4-sulfonatophenyl)iminoazaniumyl]phenyl]iminoazaniumyl]-2-sulfonatophenyl]ethenyl]-5-[[4-[oxido-(4-sulfonatophenyl)iminoazaniumyl]phenyl]diazenyl]benzenesulfonate
SYSTEMATIC NAME: tetrasodium 2-[(E)-2-[4-[oxidanidyl-[4-[oxidanidyl-(4-sulfonatophenyl)imino-azaniumyl]phenyl]imino-azaniumyl]-2-sulfonato-phenyl]ethenyl]-5-[[4-[oxidanidyl-(4-sulfonatophenyl)imino-azaniumyl]phenyl]diazenyl]benzenesulfonate
MOLECULAR FORMULA: C38H24N8Na4O15S4
MOLECULAR WEIGHT: 1052.86084
SMILES: C1=CC(=CC=C1N=NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)[N+](=NC4=CC=C(C=C4)[N+](=NC5=CC=C(C=C5)S(=O)(=O)[O-])[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[N+](=NC6=CC=C(C=C6)S(=O)(=O)[O-])[O-].[Na+].[Na+].[Na+].[Na+]
CAS RN: 73398-30-8
CAS Name: disodium 3-[3-[[9,10-dioxo-4-[4-(3-sulfonatophenyl)butan-2-ylamino]-1-anthracenyl]amino]butyl]benzenesulfonate
OPENEYE Name: disodium 3-[3-[[4-[[1-methyl-3-(3-sulfonatophenyl)propyl]amino]-9,10-dioxo-1-anthryl]amino]butyl]benzenesulfonate
IUPAC Name: disodium 3-[3-[[9,10-dioxo-4-[4-(3-sulfonatophenyl)butan-2-ylamino]anthracen-1-yl]amino]butyl]benzenesulfonate
SYSTEMATIC NAME: disodium 3-[3-[[9,10-bis(oxidanylidene)-4-[4-(3-sulfonatophenyl)butan-2-ylamino]anthracen-1-yl]amino]butyl]benzenesulfonate
MOLECULAR FORMULA: C34H32N2Na2O8S2
MOLECULAR WEIGHT: 706.73602
SMILES: CC(CCC1=CC(=CC=C1)S(=O)(=O)[O-])NC2=C3C(=C(C=C2)NC(C)CCC4=CC(=CC=C4)S(=O)(=O)[O-])C(=O)C5=CC=CC=C5C3=O.[Na+].[Na+]
CAS RN: 83006-67-1
CAS Name: disodium 5-tert-butyl-2-[[4-(4-tert-butyl-2-sulfonatoanilino)-5,8-dihydroxy-9,10-dioxo-1-anthracenyl]amino]benzenesulfonate
OPENEYE Name: disodium 5-tert-butyl-2-[[4-(4-tert-butyl-2-sulfonato-anilino)-5,8-dihydroxy-9,10-dioxo-1-anthryl]amino]benzenesulfonate
IUPAC Name: disodium 5-tert-butyl-2-[[4-(4-tert-butyl-2-sulfonatoanilino)-5,8-dihydroxy-9,10-dioxoanthracen-1-yl]amino]benzenesulfonate
SYSTEMATIC NAME: disodium 5-tert-butyl-2-[[4-[(4-tert-butyl-2-sulfonato-phenyl)amino]-5,8-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-1-yl]amino]benzenesulfonate
MOLECULAR FORMULA: C34H32N2Na2O10S2
MOLECULAR WEIGHT: 738.73482
SMILES: CC(C)(C)C1=CC(=C(C=C1)NC2=C3C(=C(C=C2)NC4=C(C=C(C=C4)C(C)(C)C)S(=O)(=O)[O-])C(=O)C5=C(C=CC(=C5C3=O)O)O)S(=O)(=O)[O-].[Na+].[Na+]
CAS RN: 93918-35-5
CAS Name: 2-[(5-octyl-2,8-dioxo-1,9-dioxa-4,6-dithia-5-stannacycloundec-5-yl)thio]acetic acid 2-[2-[(5-octyl-2,8-dioxo-1,9-dioxa-4,6-dithia-5-stannacycloundec-5-yl)thio]-1-oxoethoxy]ethyl ester
OPENEYE Name: 2-[2-[(5-octyl-2,8-dioxo-1,9-dioxa-4,6-dithia-5-stannacycloundec-5-yl)sulfanyl]acetyl]oxyethyl 2-[(5-octyl-2,8-dioxo-1,9-dioxa-4,6-dithia-5-stannacycloundec-5-yl)sulfanyl]acetate
IUPAC Name: 2-[2-[(5-octyl-2,8-dioxo-1,9-dioxa-4,6-dithia-5-stannacycloundec-5-yl)sulfanyl]acetyl]oxyethyl 2-[(5-octyl-2,8-dioxo-1,9-dioxa-4,6-dithia-5-stannacycloundec-5-yl)sulfanyl]acetate
SYSTEMATIC NAME: 2-[2-[[5-octyl-2,8-bis(oxidanylidene)-1,9-dioxa-4,6-dithia-5-stannacycloundec-5-yl]sulfanyl]ethanoyloxy]ethyl 2-[[5-octyl-2,8-bis(oxidanylidene)-1,9-dioxa-4,6-dithia-5-stannacycloundec-5-yl]sulfanyl]ethanoate
MOLECULAR FORMULA: C34H58O12S6Sn2
MOLECULAR WEIGHT: 1088.62712
SMILES: CCCCCCCC[Sn]1(SCC(=O)OCCOC(=O)CS1)SCC(=O)OCCOC(=O)CS[Sn]2(SCC(=O)OCCOC(=O)CS2)CCCCCCCC
CAS RN: 94096-31-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H16O2
MOLECULAR WEIGHT: 168.23284
SMILES: C1CC2C(C1)C3CC2C(C3O)O
CAS RN: 94109-04-3
CAS Name: acetic acid; 4-(2-methoxy-5-methylphenyl)azo-3-methyl-5-oxo-4H-pyrazole-1-carboximidamide
OPENEYE Name: acetic acid; 4-(2-methoxy-5-methyl-phenyl)azo-3-methyl-5-oxo-4H-pyrazole-1-carboxamidine
IUPAC Name: acetic acid; 4-[(2-methoxy-5-methylphenyl)diazenyl]-3-methyl-5-oxo-4H-pyrazole-1-carboximidamide
SYSTEMATIC NAME: ethanoic acid; 4-[(2-methoxy-5-methyl-phenyl)diazenyl]-3-methyl-5-oxidanylidene-4H-pyrazole-1-carboximidamide
MOLECULAR FORMULA: C15H20N6O4
MOLECULAR WEIGHT: 348.3571
SMILES: CC1=CC(=C(C=C1)OC)N=NC2C(=NN(C2=O)C(=N)N)C.CC(=O)O
CAS RN: 93803-44-2
CAS Name: 3-[[[3-(2-ethylhexoxy)-3-oxopropyl]thio]methylthio]propanoic acid 2-ethylhexyl ester
OPENEYE Name: 2-ethylhexyl 3-[[3-(2-ethylhexoxy)-3-oxo-propyl]sulfanylmethylsulfanyl]propanoate
IUPAC Name: 2-ethylhexyl 3-[[3-(2-ethylhexoxy)-3-oxopropyl]sulfanylmethylsulfanyl]propanoate
SYSTEMATIC NAME: 2-ethylhexyl 3-[[3-(2-ethylhexoxy)-3-oxidanylidene-propyl]sulfanylmethylsulfanyl]propanoate
MOLECULAR FORMULA: C23H44O4S2
MOLECULAR WEIGHT: 448.72306
SMILES: CCCCC(CC)COC(=O)CCSCSCCC(=O)OCC(CC)CCCC
CAS RN: 93919-85-8
CAS Name: sodium 2-[2-hydroxyethyl-[2-[[(Z)-1-oxooctadec-9-enyl]amino]ethyl]amino]acetate
OPENEYE Name: sodium 2-[2-hydroxyethyl-[2-[[(Z)-octadec-9-enoyl]amino]ethyl]amino]acetate
IUPAC Name: sodium 2-[2-hydroxyethyl-[2-[[(Z)-octadec-9-enoyl]amino]ethyl]amino]acetate
SYSTEMATIC NAME: sodium 2-[2-hydroxyethyl-[2-[[(Z)-octadec-9-enoyl]amino]ethyl]amino]ethanoate
MOLECULAR FORMULA: C24H45N2NaO4
MOLECULAR WEIGHT: 448.61487
SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)NCCN(CCO)CC(=O)[O-].[Na+]
CAS RN: 93965-07-2
CAS Name:
OPENEYE Name:
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SYSTEMATIC NAME:
MOLECULAR FORMULA: C49H23N3O7
MOLECULAR WEIGHT: 765.72282
SMILES: C1C2=C(C3=C(C1=O)C4=C(N3)C5=C(C6=NC7=C8C=C9C=CC(=O)C=C9C=C8C=CC7=C46)C(=O)C1=CC=CC=C1C5=O)C(=O)C1=C(C2=O)C(=CC=C1)NC(=O)C1=CC=CC=C1
CAS RN: 39330-74-0
CAS Name: cyclopenta-1,3-diene; erbium(3+)
OPENEYE Name: cyclopenta-1,3-diene; erbium(3+)
IUPAC Name: cyclopenta-1,3-diene; erbium(3+)
SYSTEMATIC NAME: cyclopenta-1,3-diene; erbium(3+)
MOLECULAR FORMULA: C15H18Er+3
MOLECULAR WEIGHT: 365.56242
SMILES: C1C=CC=C1.C1C=CC=C1.C1C=CC=C1.[Er+3]
CAS RN: 83817-74-7
CAS Name: 2,6-dimethyloct-7-en-2-yloxy-dimethoxy-methylsilane
OPENEYE Name: dimethoxy-methyl-(1,1,5-trimethylhept-6-enoxy)silane
IUPAC Name: 2,6-dimethyloct-7-en-2-yloxy-dimethoxy-methylsilane
SYSTEMATIC NAME: 2,6-dimethyloct-7-en-2-yloxy-dimethoxy-methyl-silane
MOLECULAR FORMULA: C13H28O3Si
MOLECULAR WEIGHT: 260.44512
SMILES: CC(CCCC(C)(C)O[Si](C)(OC)OC)C=C
CAS RN: 77099-06-0
CAS Name:
OPENEYE Name:
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MOLECULAR FORMULA: C36H33NO8
MOLECULAR WEIGHT: 607.64912
SMILES: CC1=CC=C(C=C1)C(=O)O[C@@H]([C@@H](C(=O)[O-])OC(=O)C2=CC=C(C=C2)C)C(=O)O.CC12C3=CC=CC=C3CC([NH2+]1)C4=CC=CC=C24
CAS RN: 84682-06-4
CAS Name: 5-[1-(2-chloroanilino)-1,3-dioxobutan-2-yl]azo-2-[4-[1-(2-chloroanilino)-1,3-dioxobutan-2-yl]azo-2-sulfophenyl]benzenesulfonic acid
OPENEYE Name: 5-[1-[(2-chlorophenyl)carbamoyl]-2-oxo-propyl]azo-2-[4-[1-[(2-chlorophenyl)carbamoyl]-2-oxo-propyl]azo-2-sulfo-phenyl]benzenesulfonic acid
IUPAC Name: 5-[[1-(2-chloroanilino)-1,3-dioxobutan-2-yl]diazenyl]-2-[4-[[1-(2-chloroanilino)-1,3-dioxobutan-2-yl]diazenyl]-2-sulfophenyl]benzenesulfonic acid
SYSTEMATIC NAME: 5-[[1-[(2-chlorophenyl)amino]-1,3-bis(oxidanylidene)butan-2-yl]diazenyl]-2-[4-[[1-[(2-chlorophenyl)amino]-1,3-bis(oxidanylidene)butan-2-yl]diazenyl]-2-sulfo-phenyl]benzenesulfonic acid
MOLECULAR FORMULA: C32H26Cl2N6O10S2
MOLECULAR WEIGHT: 789.61904
SMILES: CC(=O)C(C(=O)NC1=CC=CC=C1Cl)N=NC2=CC(=C(C=C2)C3=C(C=C(C=C3)N=NC(C(=O)C)C(=O)NC4=CC=CC=C4Cl)S(=O)(=O)O)S(=O)(=O)O
CAS RN: 85391-81-7
CAS Name: 2,4-dibutyl-2,4-bis(dodecylthio)-7-(ethylthio)-1,5-dioxa-3-thia-2,4-distannacycloundecane-6,11-dione
OPENEYE Name: 2,4-dibutyl-2,4-bis(dodecylsulfanyl)-7-ethylsulfanyl-1,5-dioxa-3-thia-2,4-distannacycloundecane-6,11-dione
IUPAC Name: 2,4-dibutyl-2,4-bis(dodecylsulfanyl)-7-ethylsulfanyl-1,5-dioxa-3-thia-2,4-distannacycloundecane-6,11-dione
SYSTEMATIC NAME: 2,4-dibutyl-2,4-bis(dodecylsulfanyl)-7-ethylsulfanyl-1,5-dioxa-3-thia-2,4-distannacycloundecane-6,11-dione
MOLECULAR FORMULA: C40H80O4S4Sn2
MOLECULAR WEIGHT: 990.7408
SMILES: CCCCCCCCCCCCS[Sn]1(OC(=O)CCCC(C(=O)O[Sn](S1)(CCCC)SCCCCCCCCCCCC)SCC)CCCC
CAS RN: 71889-57-1
CAS Name: 2-[bis(2-hydroxyethyl)amino]ethanol; eicosanoic acid
OPENEYE Name: 2-[bis(2-hydroxyethyl)amino]ethanol; icosanoic acid
IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol; icosanoic acid
SYSTEMATIC NAME: 2-[bis(2-hydroxyethyl)amino]ethanol; icosanoic acid
MOLECULAR FORMULA: C26H55NO5
MOLECULAR WEIGHT: 461.7186
SMILES: CCCCCCCCCCCCCCCCCCCC(=O)O.C(CO)N(CCO)CCO
CAS RN: 83249-55-2
CAS Name: tetrasodium 2-[2-acetamido-4-[[[3-acetamido-4-[2-sulfonato-4-(4-sulfonatophenyl)azophenyl]azoanilino]-oxomethyl]amino]phenyl]azo-5-(4-sulfonatophenyl)azobenzenesulfonate
OPENEYE Name: tetrasodium 2-[2-acetamido-4-[[3-acetamido-4-[2-sulfonato-4-(4-sulfonatophenyl)azo-phenyl]azo-phenyl]carbamoylamino]phenyl]azo-5-(4-sulfonatophenyl)azo-benzenesulfonate
IUPAC Name: tetrasodium 2-[[2-acetamido-4-[[3-acetamido-4-[[2-sulfonato-4-[(4-sulfonatophenyl)diazenyl]phenyl]diazenyl]phenyl]carbamoylamino]phenyl]diazenyl]-5-[(4-sulfonatophenyl)diazenyl]benzenesulfonate
SYSTEMATIC NAME: tetrasodium 2-[[2-acetamido-4-[[3-acetamido-4-[[2-sulfonato-4-[(4-sulfonatophenyl)diazenyl]phenyl]diazenyl]phenyl]carbamoylamino]phenyl]diazenyl]-5-[(4-sulfonatophenyl)diazenyl]benzenesulfonate
MOLECULAR FORMULA: C41H30N12Na4O15S4
MOLECULAR WEIGHT: 1150.96738
SMILES: CC(=O)NC1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)N=NC3=C(C=C(C=C3)N=NC4=CC=C(C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)C)N=NC5=C(C=C(C=C5)N=NC6=CC=C(C=C6)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]
CAS RN: 80044-11-7
CAS Name: ammonia; 2-(chloromethyl)oxirane; hydrochloride
OPENEYE Name: ammonia; 2-(chloromethyl)oxirane; hydrochloride
IUPAC Name: azane; 2-(chloromethyl)oxirane; hydrochloride
SYSTEMATIC NAME: azane; 2-(chloromethyl)oxirane; hydrochloride
MOLECULAR FORMULA: C3H9Cl2NO
MOLECULAR WEIGHT: 146.01566
SMILES: C1C(O1)CCl.N.Cl
CAS RN: 93981-83-0
CAS Name: propanoic acid 11-methyldodecyl ester
OPENEYE Name: 11-methyldodecyl propanoate
IUPAC Name: 11-methyldodecyl propanoate
SYSTEMATIC NAME: 11-methyldodecyl propanoate
MOLECULAR FORMULA: C16H32O2
MOLECULAR WEIGHT: 256.42408
SMILES: CCC(=O)OCCCCCCCCCCC(C)C
CAS RN: 72175-30-5
CAS Name: N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine; hexanedioic acid dimethyl ester; pentanedioic acid dimethyl ester
OPENEYE Name: N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine; dimethyl hexanedioate; dimethyl pentanedioate
IUPAC Name: N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine; dimethyl hexanedioate; dimethyl pentanedioate
SYSTEMATIC NAME: N'-[2-[2-(2-azanylethylamino)ethylamino]ethyl]ethane-1,2-diamine; dimethyl hexanedioate; dimethyl pentanedioate
MOLECULAR FORMULA: C23H49N5O8
MOLECULAR WEIGHT: 523.66386
SMILES: COC(=O)CCCCC(=O)OC.COC(=O)CCCC(=O)OC.C(CNCCNCCNCCN)N
CAS RN: 114269-35-1
CAS Name: N-methylcarbamic acid (2-propan-2-yloxyphenyl) ester; phosphoric acid 2,2-dichloroethenyl dimethyl ester
OPENEYE Name: 2,2-dichlorovinyl dimethyl phosphate; (2-isopropoxyphenyl) N-methylcarbamate
IUPAC Name: 2,2-dichloroethenyl dimethyl phosphate; (2-propan-2-yloxyphenyl) N-methylcarbamate
SYSTEMATIC NAME: 2,2-bis(chloranyl)ethenyl dimethyl phosphate; (2-propan-2-yloxyphenyl) N-methylcarbamate
MOLECULAR FORMULA: C15H22Cl2NO7P
MOLECULAR WEIGHT: 430.217441
SMILES: CC(C)OC1=CC=CC=C1OC(=O)NC.COP(=O)(OC)OC=C(Cl)Cl
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