CAS RN: 12503-65-0
CAS Name: lead(2+); oxygen(2-); ruthenium(4+)
OPENEYE Name: plumbous; oxygen(2-); ruthenium(4+)
IUPAC Name: lead(2+); oxygen(2-); ruthenium(4+)
SYSTEMATIC NAME: lead(2+); oxygen(2-); ruthenium(4+)
MOLECULAR FORMULA: OPbRu+4
MOLECULAR WEIGHT: 324.2694
SMILES: [O-2].[Ru+4].[Pb+2]
Structure:
CAS RN: 37064-30-5
CAS Name: (2R,3R,4S)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-8-yl]-8-[(2R,3R,4R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-4-yl]-3,4-dihydro-2H-1-benzopyran-3,5,7-triol
OPENEYE Name: (2R,3R,4S)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-chroman-8-yl]-8-[(2R,3R,4R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-chroman-4-yl]chromane-3,5,7-triol
IUPAC Name: (2R,3R,4S)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-8-[(2R,3R,4R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol
SYSTEMATIC NAME: (2R,3R,4S)-2-[3,4-bis(oxidanyl)phenyl]-4-[(2R,3R)-2-[3,4-bis(oxidanyl)phenyl]-3,5,7-tris(oxidanyl)-3,4-dihydro-2H-chromen-8-yl]-8-[(2R,3R,4R)-2-[3,4-bis(oxidanyl)phenyl]-3,5,7-tris(oxidanyl)-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol
MOLECULAR FORMULA: C45H38O18
MOLECULAR WEIGHT: 866.77242
SMILES: C1[C@H]([C@H](OC2=C1C(=CC(=C2[C@@H]3[C@H]([C@H](OC4=C(C(=CC(=C34)O)O)[C@@H]5[C@H]([C@H](OC6=CC(=CC(=C56)O)O)C7=CC(=C(C=C7)O)O)O)C8=CC(=C(C=C8)O)O)O)O)O)C9=CC(=C(C=C9)O)O)O
Structure:
CAS RN: 41863-46-1
CAS Name: (6R,7R)-7-[[2-amino-2-(1-cyclohexenyl)-1-oxoethyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
OPENEYE Name: (6R,7R)-7-[[2-amino-2-(cyclohexen-1-yl)acetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC Name: (6R,7R)-7-[[2-amino-2-(cyclohexen-1-yl)acetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: (6R,7R)-7-[[2-azanyl-2-(cyclohexen-1-yl)ethanoyl]amino]-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C16H21N3O4S
MOLECULAR WEIGHT: 351.42064
SMILES: CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)C(C3=CCCCC3)N)SC1)C(=O)O
Structure:
CAS RN: 37021-14-0
CAS Name: 3-ethyl-1-phenyl-2-sulfanylidene-4-imidazolidinone
OPENEYE Name: 3-ethyl-1-phenyl-2-thioxo-imidazolidin-4-one
IUPAC Name: 3-ethyl-1-phenyl-2-sulfanylideneimidazolidin-4-one
SYSTEMATIC NAME: 3-ethyl-1-phenyl-2-sulfanylidene-imidazolidin-4-one
MOLECULAR FORMULA: C11H12N2OS
MOLECULAR WEIGHT: 220.29078
SMILES: CCN1C(=O)CN(C1=S)C2=CC=CC=C2
Structure:
CAS RN: 41692-58-4
CAS Name: 1-(3,5-diiodophenyl)pyrrolidine-2,5-dione
OPENEYE Name: 1-(3,5-diiodophenyl)pyrrolidine-2,5-dione
IUPAC Name: 1-(3,5-diiodophenyl)pyrrolidine-2,5-dione
SYSTEMATIC NAME: 1-[3,5-bis(iodanyl)phenyl]pyrrolidine-2,5-dione
MOLECULAR FORMULA: C10H7I2NO2
MOLECULAR WEIGHT: 426.97702
SMILES: C1CC(=O)N(C1=O)C2=CC(=CC(=C2)I)I
Structure:
CAS RN: 36996-87-9
CAS Name: 2-[2-(dimethylamino)ethoxymethoxy]-N,N-dimethylethanamine
OPENEYE Name: 2-[2-(dimethylamino)ethoxymethoxy]-N,N-dimethyl-ethanamine
IUPAC Name: 2-[2-(dimethylamino)ethoxymethoxy]-N,N-dimethylethanamine
SYSTEMATIC NAME: 2-[2-(dimethylamino)ethoxymethoxy]-N,N-dimethyl-ethanamine
MOLECULAR FORMULA: C9H22N2O2
MOLECULAR WEIGHT: 190.28318
SMILES: CN(C)CCOCOCCN(C)C
Structure:
CAS RN: 36880-33-8
CAS Name: 5-ethyl-2-thiophenecarboxaldehyde
OPENEYE Name: 5-ethylthiophene-2-carbaldehyde
IUPAC Name: 5-ethylthiophene-2-carbaldehyde
SYSTEMATIC NAME: 5-ethylthiophene-2-carbaldehyde
MOLECULAR FORMULA: C7H8OS
MOLECULAR WEIGHT: 140.20282
SMILES: CCC1=CC=C(S1)C=O
Structure:
CAS RN: 41613-02-9
CAS Name: (2S)-2-aminopentanedioic acid; (2S)-2-amino-3-phenylpropanoic acid; (2S)-2,6-diaminohexanoic acid
OPENEYE Name: (2S)-2-aminopentanedioic acid; (2S)-2-amino-3-phenyl-propanoic acid; (2S)-2,6-diaminohexanoic acid
IUPAC Name: (2S)-2-aminopentanedioic acid; (2S)-2-amino-3-phenylpropanoic acid; (2S)-2,6-diaminohexanoic acid
SYSTEMATIC NAME: (2S)-2-azanylpentanedioic acid; (2S)-2-azanyl-3-phenyl-propanoic acid; (2S)-2,6-bis(azanyl)hexanoic acid
MOLECULAR FORMULA: C20H34N4O8
MOLECULAR WEIGHT: 458.50596
SMILES: C1=CC=C(C=C1)C[C@@H](C(=O)O)N.C(CCN)C[C@@H](C(=O)O)N.C(CC(=O)O)[C@@H](C(=O)O)N
Structure:
CAS RN: 41610-49-5
CAS Name: (3S,7R,8S,9S,10R,13R,14S)-7-hydroperoxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
OPENEYE Name: (3S,7R,8S,9S,10R,13R,14S)-17-[(1R)-1,5-dimethylhexyl]-7-hydroperoxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
IUPAC Name: (3S,7R,8S,9S,10R,13R,14S)-7-hydroperoxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
SYSTEMATIC NAME: (3S,7R,8S,9S,10R,13R,14S)-7-(dioxidanyl)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
MOLECULAR FORMULA: C27H46O3
MOLECULAR WEIGHT: 418.65234
SMILES: C[C@H](CCCC(C)C)C1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H](C=C4[C@@]3(CC[C@@H](C4)O)C)OO)C
Structure:
CAS RN: 31602-99-0
CAS Name: 2-methyl-6-(5-methyl-2-oxo-4-imidazolidinyl)hexanoic acid
OPENEYE Name: 2-methyl-6-(5-methyl-2-oxo-imidazolidin-4-yl)hexanoic acid
IUPAC Name: 2-methyl-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanoic acid
SYSTEMATIC NAME: 2-methyl-6-(5-methyl-2-oxidanylidene-imidazolidin-4-yl)hexanoic acid
MOLECULAR FORMULA: C11H20N2O3
MOLECULAR WEIGHT: 228.2881
SMILES: CC1C(NC(=O)N1)CCCCC(C)C(=O)O
Structure:
CAS RN: 41568-88-1
CAS Name: 1,1-bis(2-hydroxyethyl)-3-octadecylurea
OPENEYE Name: 1,1-bis(2-hydroxyethyl)-3-octadecyl-urea
IUPAC Name: 1,1-bis(2-hydroxyethyl)-3-octadecylurea
SYSTEMATIC NAME: 1,1-bis(2-hydroxyethyl)-3-octadecyl-urea
MOLECULAR FORMULA: C23H48N2O3
MOLECULAR WEIGHT: 400.63882
SMILES: CCCCCCCCCCCCCCCCCCNC(=O)N(CCO)CCO
Structure:
CAS RN: 36833-16-6
CAS Name: 1,3,3a,4,6,6a-hexahydroimidazo[4,5-d]imidazole-2,5-dione; formaldehyde
OPENEYE Name: 1,3,3a,4,6,6a-hexahydroimidazo[4,5-d]imidazole-2,5-dione; formaldehyde
IUPAC Name: 1,3,3a,4,6,6a-hexahydroimidazo[4,5-d]imidazole-2,5-dione; formaldehyde
SYSTEMATIC NAME: 1,3,3a,4,6,6a-hexahydroimidazo[4,5-d]imidazole-2,5-dione; methanal
MOLECULAR FORMULA: C5H8N4O3
MOLECULAR WEIGHT: 172.14202
SMILES: C=O.C12C(NC(=O)N1)NC(=O)N2
Structure:
CAS RN: 36806-46-9
CAS Name: 2,6-dimethyl-6-hepten-1-ol
OPENEYE Name: 2,6-dimethylhept-6-en-1-ol
IUPAC Name: 2,6-dimethylhept-6-en-1-ol
SYSTEMATIC NAME: 2,6-dimethylhept-6-en-1-ol
MOLECULAR FORMULA: C9H18O
MOLECULAR WEIGHT: 142.23862
SMILES: CC(CCCC(=C)C)CO
Structure:
CAS RN: 26259-91-6
CAS Name: phosphorous acid 2-(3-hydroxy-2,3-dimethylbutan-2-yl)oxyethyl 2-(2-hydroxyethoxy)ethyl 1-(3-hydroxypropoxy)propan-2-yl ester
OPENEYE Name: 2-(2-hydroxyethoxy)ethyl [2-(3-hydroxypropoxy)-1-methyl-ethyl] 2-(2-hydroxy-1,1,2-trimethyl-propoxy)ethyl phosphite
IUPAC Name: 2-(3-hydroxy-2,3-dimethylbutan-2-yl)oxyethyl 2-(2-hydroxyethoxy)ethyl 1-(3-hydroxypropoxy)propan-2-yl phosphite
SYSTEMATIC NAME: 2-(2,3-dimethyl-3-oxidanyl-butan-2-yl)oxyethyl 2-(2-hydroxyethyloxy)ethyl 1-(3-oxidanylpropoxy)propan-2-yl phosphite
MOLECULAR FORMULA: C18H39O9P
MOLECULAR WEIGHT: 430.470621
SMILES: CC(COCCCO)OP(OCCOCCO)OCCOC(C)(C)C(C)(C)O
Structure:
CAS RN: 134247-64-6
CAS Name: 3-(N-ethyl-3-methylanilino)-1-propanesulfonic acid
OPENEYE Name: 3-(N-ethyl-3-methyl-anilino)propane-1-sulfonic acid
IUPAC Name: 3-(N-ethyl-3-methylanilino)propane-1-sulfonic acid
SYSTEMATIC NAME: 3-[ethyl-(3-methylphenyl)amino]propane-1-sulfonic acid
MOLECULAR FORMULA: C12H19NO3S
MOLECULAR WEIGHT: 257.34916
SMILES: CCN(CCCS(=O)(=O)O)C1=CC=CC(=C1)C
Structure:
CAS RN: 36777-15-8
CAS Name: 2-[[7-(trifluoromethyl)-4-quinolinyl]amino]benzoic acid
OPENEYE Name: 2-[[7-(trifluoromethyl)-4-quinolyl]amino]benzoic acid
IUPAC Name: 2-[[7-(trifluoromethyl)quinolin-4-yl]amino]benzoic acid
SYSTEMATIC NAME: 2-[[7-(trifluoromethyl)quinolin-4-yl]amino]benzoic acid
MOLECULAR FORMULA: C17H11F3N2O2
MOLECULAR WEIGHT: 332.27665
SMILES: C1=CC=C(C(=C1)C(=O)O)NC2=C3C=CC(=CC3=NC=C2)C(F)(F)F
Structure:
CAS RN: 36775-31-2
CAS Name: (2R)-2-amino-2-phenylacetic acid; [(1R,4S)-7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl]methanesulfonic acid
OPENEYE Name: (2R)-2-amino-2-phenyl-acetic acid; [(1S,4R)-7,7-dimethyl-2-oxo-norbornan-1-yl]methanesulfonic acid
IUPAC Name: (2R)-2-amino-2-phenylacetic acid; [(1R,4S)-7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl]methanesulfonic acid
SYSTEMATIC NAME: (2R)-2-azanyl-2-phenyl-ethanoic acid; [(1R,4S)-7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl]methanesulfonic acid
MOLECULAR FORMULA: C18H25NO6S
MOLECULAR WEIGHT: 383.4592
SMILES: CC1([C@@H]2CC[C@]1(C(=O)C2)CS(=O)(=O)O)C.C1=CC=C(C=C1)[C@H](C(=O)O)N
Structure:
CAS RN: 41495-66-3
CAS Name: 2-iodoacetic acid (1-$l^{1}-oxidanyl-2,2,6,6-tetramethyl-4-piperidinyl) ester
OPENEYE Name: (1-$l^{1}-oxidanyl-2,2,6,6-tetramethyl-4-piperidyl) 2-iodoacetate
IUPAC Name: (1-$l^{1}-oxidanyl-2,2,6,6-tetramethylpiperidin-4-yl) 2-iodoacetate
SYSTEMATIC NAME: (1-$l^{1}-oxidanyl-2,2,6,6-tetramethyl-piperidin-4-yl) 2-iodanylethanoate
MOLECULAR FORMULA: C11H19INO3
MOLECULAR WEIGHT: 340.17793
SMILES: CC1(CC(CC(N1[O])(C)C)OC(=O)CI)C
Structure:
CAS RN: 105692-44-2
CAS Name: 2-(chloromethyl)oxirane; ethane-1,2-diamine; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
OPENEYE Name: 2-(chloromethyl)oxirane; ethane-1,2-diamine; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol
IUPAC Name: 2-(chloromethyl)oxirane; ethane-1,2-diamine; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
SYSTEMATIC NAME: 2-(chloromethyl)oxirane; ethane-1,2-diamine; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
MOLECULAR FORMULA: C20H29ClN2O3
MOLECULAR WEIGHT: 380.90886
SMILES: CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl.C(CN)N
Structure:
CAS RN: 36704-31-1
CAS Name: 2-(chloromethyl)oxirane; ethane-1,2-diamine; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
OPENEYE Name: 2-(chloromethyl)oxirane; ethane-1,2-diamine; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol
IUPAC Name: 2-(chloromethyl)oxirane; ethane-1,2-diamine; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
SYSTEMATIC NAME: 2-(chloromethyl)oxirane; ethane-1,2-diamine; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
MOLECULAR FORMULA: C20H29ClN2O3
MOLECULAR WEIGHT: 380.90886
SMILES: CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl.C(CN)N
Structure:
CAS RN: 36702-84-8
CAS Name: 2-[3,3-bis(3-thiophenyl)prop-2-enylamino]-1-phenyl-1-propanol hydrochloride
OPENEYE Name: 2-[3,3-bis(3-thienyl)allylamino]-1-phenyl-propan-1-ol hydrochloride
IUPAC Name: 2-[3,3-di(thiophen-3-yl)prop-2-enylamino]-1-phenylpropan-1-ol hydrochloride
SYSTEMATIC NAME: 2-[3,3-di(thiophen-3-yl)prop-2-enylamino]-1-phenyl-propan-1-ol hydrochloride
MOLECULAR FORMULA: C20H22ClNOS2
MOLECULAR WEIGHT: 391.97778
SMILES: CC(C(C1=CC=CC=C1)O)NCC=C(C2=CSC=C2)C3=CSC=C3.Cl
Structure:
CAS RN: 924890-06-2
CAS Name: benzene-1,2,4-tricarboxylic acid tris(8-methylnonyl) ester
OPENEYE Name: tris(8-methylnonyl) benzene-1,2,4-tricarboxylate
IUPAC Name: tris(8-methylnonyl) benzene-1,2,4-tricarboxylate
SYSTEMATIC NAME: tris(8-methylnonyl) benzene-1,2,4-tricarboxylate
MOLECULAR FORMULA: C39H66O6
MOLECULAR WEIGHT: 630.93774
SMILES: CC(C)CCCCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCCCCC(C)C)C(=O)OCCCCCCCC(C)C
Structure:
CAS RN: 80750-21-6
CAS Name: 8-[3-(tert-butylamino)-2-hydroxypropoxy]-5-methyl-1-benzopyran-2-one
OPENEYE Name: 8-[3-(tert-butylamino)-2-hydroxy-propoxy]-5-methyl-chromen-2-one
IUPAC Name: 8-[3-(tert-butylamino)-2-hydroxypropoxy]-5-methylchromen-2-one
SYSTEMATIC NAME: 8-[3-(tert-butylamino)-2-oxidanyl-propoxy]-5-methyl-chromen-2-one
MOLECULAR FORMULA: C17H23NO4
MOLECULAR WEIGHT: 305.36882
SMILES: CC1=C2C=CC(=O)OC2=C(C=C1)OCC(CNC(C)(C)C)O
Structure:
CAS RN: 12125-39-2
CAS Name: diammonium iridium hexabromide
OPENEYE Name: diammonium iridium hexabromide
IUPAC Name: diazanium iridium hexabromide
SYSTEMATIC NAME: diazanium iridium hexabromide
MOLECULAR FORMULA: Br6H8IrN2-4
MOLECULAR WEIGHT: 707.71792
SMILES: [NH4+].[NH4+].[Br-].[Br-].[Br-].[Br-].[Br-].[Br-].[Ir]
Structure:
CAS RN: 36530-24-2
CAS Name: diammonium iridium hexabromide
OPENEYE Name: diammonium iridium hexabromide
IUPAC Name: diazanium iridium hexabromide
SYSTEMATIC NAME: diazanium iridium hexabromide
MOLECULAR FORMULA: Br6H8IrN2-4
MOLECULAR WEIGHT: 707.71792
SMILES: [NH4+].[NH4+].[Br-].[Br-].[Br-].[Br-].[Br-].[Br-].[Ir]
Structure:
CAS RN: 42392-31-4
CAS Name: octadecanoic acid [(3R,4S)-4-hydroxy-2-[(1R)-2-hydroxy-1-(1-oxooctadecoxy)ethyl]-3-oxolanyl] ester
OPENEYE Name: [(3R,4S)-4-hydroxy-2-[(1R)-2-hydroxy-1-octadecanoyloxy-ethyl]tetrahydrofuran-3-yl] octadecanoate
IUPAC Name: [(3R,4S)-4-hydroxy-2-[(1R)-2-hydroxy-1-octadecanoyloxyethyl]oxolan-3-yl] octadecanoate
SYSTEMATIC NAME: [(3R,4S)-2-[(1R)-1-octadecanoyloxy-2-oxidanyl-ethyl]-4-oxidanyl-oxolan-3-yl] octadecanoate
MOLECULAR FORMULA: C42H80O7
MOLECULAR WEIGHT: 697.0804
SMILES: CCCCCCCCCCCCCCCCCC(=O)O[C@@H]1[C@H](COC1[C@@H](CO)OC(=O)CCCCCCCCCCCCCCCCC)O
Structure:
CAS RN: 36521-89-8
CAS Name: octadecanoic acid [(3R,4S)-4-hydroxy-2-[(1R)-2-hydroxy-1-(1-oxooctadecoxy)ethyl]-3-oxolanyl] ester
OPENEYE Name: [(3R,4S)-4-hydroxy-2-[(1R)-2-hydroxy-1-octadecanoyloxy-ethyl]tetrahydrofuran-3-yl] octadecanoate
IUPAC Name: [(3R,4S)-4-hydroxy-2-[(1R)-2-hydroxy-1-octadecanoyloxyethyl]oxolan-3-yl] octadecanoate
SYSTEMATIC NAME: [(3R,4S)-2-[(1R)-1-octadecanoyloxy-2-oxidanyl-ethyl]-4-oxidanyl-oxolan-3-yl] octadecanoate
MOLECULAR FORMULA: C42H80O7
MOLECULAR WEIGHT: 697.0804
SMILES: CCCCCCCCCCCCCCCCCC(=O)O[C@@H]1[C@H](COC1[C@@H](CO)OC(=O)CCCCCCCCCCCCCCCCC)O
Structure:
CAS RN: 4125-54-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H28NO6+
MOLECULAR WEIGHT: 366.42872
SMILES: CCC1CC(=C)C(C(=O)OCC2=CC[N+]3(C2([C@@H](CC3)OC1=O)O)C)(C)O
Structure:
CAS RN: 36497-34-4
CAS Name: dodecane-1,12-diamine; dodecanedioic acid
OPENEYE Name: dodecane-1,12-diamine; dodecanedioic acid
IUPAC Name: dodecane-1,12-diamine; dodecanedioic acid
SYSTEMATIC NAME: dodecane-1,12-diamine; dodecanedioic acid
MOLECULAR FORMULA: C24H50N2O4
MOLECULAR WEIGHT: 430.6648
SMILES: C(CCCCCCN)CCCCCN.C(CCCCCC(=O)O)CCCCC(=O)O
Structure:
CAS RN: 36431-73-9
CAS Name: 4-bromo-5-ethyl-8-pent-2-en-4-ynyl-6,9-dioxabicyclo[5.2.1]decan-2-ol
OPENEYE Name: 4-bromo-5-ethyl-8-pent-2-en-4-ynyl-6,9-dioxabicyclo[5.2.1]decan-2-ol
IUPAC Name: 4-bromo-5-ethyl-8-pent-2-en-4-ynyl-6,9-dioxabicyclo[5.2.1]decan-2-ol
SYSTEMATIC NAME: 4-bromanyl-5-ethyl-8-pent-2-en-4-ynyl-6,9-dioxabicyclo[5.2.1]decan-2-ol
MOLECULAR FORMULA: C15H21BrO3
MOLECULAR WEIGHT: 329.22944
SMILES: CCC1C(CC(C2CC(O1)C(O2)CC=CC#C)O)Br
Structure:
CAS RN: 101993-34-4
CAS Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methyl-2-propenoic acid
OPENEYE Name: 2-(chloromethyl)oxirane; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; 2-methylprop-2-enoic acid
IUPAC Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methylprop-2-enoic acid
SYSTEMATIC NAME: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methylprop-2-enoic acid
MOLECULAR FORMULA: C22H27ClO5
MOLECULAR WEIGHT: 406.89978
SMILES: CC(=C)C(=O)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl
Structure:
CAS RN: 126602-15-1
CAS Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methyl-2-propenoic acid
OPENEYE Name: 2-(chloromethyl)oxirane; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; 2-methylprop-2-enoic acid
IUPAC Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methylprop-2-enoic acid
SYSTEMATIC NAME: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methylprop-2-enoic acid
MOLECULAR FORMULA: C22H27ClO5
MOLECULAR WEIGHT: 406.89978
SMILES: CC(=C)C(=O)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl
Structure:
CAS RN: 219911-24-7
CAS Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methyl-2-propenoic acid
OPENEYE Name: 2-(chloromethyl)oxirane; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; 2-methylprop-2-enoic acid
IUPAC Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methylprop-2-enoic acid
SYSTEMATIC NAME: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methylprop-2-enoic acid
MOLECULAR FORMULA: C22H27ClO5
MOLECULAR WEIGHT: 406.89978
SMILES: CC(=C)C(=O)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl
Structure:
CAS RN: 306773-05-7
CAS Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methyl-2-propenoic acid
OPENEYE Name: 2-(chloromethyl)oxirane; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; 2-methylprop-2-enoic acid
IUPAC Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methylprop-2-enoic acid
SYSTEMATIC NAME: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methylprop-2-enoic acid
MOLECULAR FORMULA: C22H27ClO5
MOLECULAR WEIGHT: 406.89978
SMILES: CC(=C)C(=O)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl
Structure:
CAS RN: 36425-15-7
CAS Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methyl-2-propenoic acid
OPENEYE Name: 2-(chloromethyl)oxirane; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; 2-methylprop-2-enoic acid
IUPAC Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methylprop-2-enoic acid
SYSTEMATIC NAME: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methylprop-2-enoic acid
MOLECULAR FORMULA: C22H27ClO5
MOLECULAR WEIGHT: 406.89978
SMILES: CC(=C)C(=O)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl
Structure:
CAS RN: 37342-21-5
CAS Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methyl-2-propenoic acid
OPENEYE Name: 2-(chloromethyl)oxirane; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; 2-methylprop-2-enoic acid
IUPAC Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methylprop-2-enoic acid
SYSTEMATIC NAME: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methylprop-2-enoic acid
MOLECULAR FORMULA: C22H27ClO5
MOLECULAR WEIGHT: 406.89978
SMILES: CC(=C)C(=O)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl
Structure:
CAS RN: 61970-25-0
CAS Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methyl-2-propenoic acid
OPENEYE Name: 2-(chloromethyl)oxirane; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; 2-methylprop-2-enoic acid
IUPAC Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methylprop-2-enoic acid
SYSTEMATIC NAME: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methylprop-2-enoic acid
MOLECULAR FORMULA: C22H27ClO5
MOLECULAR WEIGHT: 406.89978
SMILES: CC(=C)C(=O)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl
Structure:
CAS RN: 62084-84-8
CAS Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methyl-2-propenoic acid
OPENEYE Name: 2-(chloromethyl)oxirane; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; 2-methylprop-2-enoic acid
IUPAC Name: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methylprop-2-enoic acid
SYSTEMATIC NAME: 2-(chloromethyl)oxirane; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-methylprop-2-enoic acid
MOLECULAR FORMULA: C22H27ClO5
MOLECULAR WEIGHT: 406.89978
SMILES: CC(=C)C(=O)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl
Structure:
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