CAS RN: 5448-26-0
CAS Name: (3R,5R,8R,9S,10S)-17-ethyl-10,17-dimethyl-2,3,4,5,6,7,8,9,11,12,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
OPENEYE Name: (3R,5R,8R,9S,10S)-17-ethyl-10,17-dimethyl-2,3,4,5,6,7,8,9,11,12,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
IUPAC Name: (3R,5R,8R,9S,10S)-17-ethyl-10,17-dimethyl-2,3,4,5,6,7,8,9,11,12,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
SYSTEMATIC NAME: (3R,5R,8R,9S,10S)-17-ethyl-10,17-dimethyl-2,3,4,5,6,7,8,9,11,12,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
MOLECULAR FORMULA: C21H34O
MOLECULAR WEIGHT: 302.49406
SMILES: CCC1(CCC2=C1CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C
Structure:
CAS RN: 156862-51-0
CAS Name: 3-[2-[(1S,5R,6S)-6-(4-fluorophenyl)-3-azabicyclo[3.2.0]heptan-3-yl]ethyl]-1H-quinazoline-2,4-dione
OPENEYE Name: 3-[2-[(1S,5R,6S)-6-(4-fluorophenyl)-3-azabicyclo[3.2.0]heptan-3-yl]ethyl]-1H-quinazoline-2,4-dione
IUPAC Name: 3-[2-[(1S,5R,6S)-6-(4-fluorophenyl)-3-azabicyclo[3.2.0]heptan-3-yl]ethyl]-1H-quinazoline-2,4-dione
SYSTEMATIC NAME: 3-[2-[(1S,5R,6S)-6-(4-fluorophenyl)-3-azabicyclo[3.2.0]heptan-3-yl]ethyl]-1H-quinazoline-2,4-dione
MOLECULAR FORMULA: C22H22FN3O2
MOLECULAR WEIGHT: 379.427383
SMILES: C1[C@@H]2CN(C[C@@H]2[C@H]1C3=CC=C(C=C3)F)CCN4C(=O)C5=CC=CC=C5NC4=O
Structure:
CAS RN: 117918-56-6
CAS Name: 3,4-dichloro-N-[4-(trifluoromethyl)phenyl]benzenesulfonamide
OPENEYE Name: 3,4-dichloro-N-[4-(trifluoromethyl)phenyl]benzenesulfonamide
IUPAC Name: 3,4-dichloro-N-[4-(trifluoromethyl)phenyl]benzenesulfonamide
SYSTEMATIC NAME: 3,4-bis(chloranyl)-N-[4-(trifluoromethyl)phenyl]benzenesulfonamide
MOLECULAR FORMULA: C13H8Cl2F3NO2S
MOLECULAR WEIGHT: 370.17433
SMILES: C1=CC(=CC=C1C(F)(F)F)NS(=O)(=O)C2=CC(=C(C=C2)Cl)Cl
Structure:
CAS RN: 117900-35-3
CAS Name: (1R,3R)-3-(2,2-dibromoethenyl)-2,2-dimethyl-1-cyclopropanecarboxylic acid [(S)-cyano-(3-phenoxyphenyl)methyl] ester; 2-(dimethoxyphosphinothioylthio)-N-methylacetamide
OPENEYE Name: [(S)-cyano-(3-phenoxyphenyl)methyl] (1R,3R)-3-(2,2-dibromovinyl)-2,2-dimethyl-cyclopropanecarboxylate; 2-dimethoxyphosphinothioylsulfanyl-N-methyl-acetamide
IUPAC Name: [(S)-cyano-(3-phenoxyphenyl)methyl] (1R,3R)-3-(2,2-dibromoethenyl)-2,2-dimethylcyclopropane-1-carboxylate; 2-dimethoxyphosphinothioylsulfanyl-N-methylacetamide
SYSTEMATIC NAME: [(S)-cyano-(3-phenoxyphenyl)methyl] (1R,3R)-3-[2,2-bis(bromanyl)ethenyl]-2,2-dimethyl-cyclopropane-1-carboxylate; 2-dimethoxyphosphinothioylsulfanyl-N-methyl-ethanamide
MOLECULAR FORMULA: C27H31Br2N2O6PS2
MOLECULAR WEIGHT: 734.456601
SMILES: CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Br)Br)C.CNC(=O)CSP(=S)(OC)OC
Structure:
CAS RN: 117842-21-4
CAS Name: (3S,3aR,5aR,5bR,7aS,11aS,11bR,13aR,13bS)-3-ethyl-5a,5b,8,8,9,11a,13b-heptamethyl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysene
OPENEYE Name: (3S,3aR,5aR,5bR,7aS,11aS,11bR,13aR,13bS)-3-ethyl-5a,5b,8,8,9,11a,13b-heptamethyl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysene
IUPAC Name: (3S,3aR,5aR,5bR,7aS,11aS,11bR,13aR,13bS)-3-ethyl-5a,5b,8,8,9,11a,13b-heptamethyl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysene
SYSTEMATIC NAME: (3S,3aR,5aR,5bR,7aS,11aS,11bR,13aR,13bS)-3-ethyl-5a,5b,8,8,9,11a,13b-heptamethyl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysene
MOLECULAR FORMULA: C30H52
MOLECULAR WEIGHT: 412.73388
SMILES: CC[C@H]1CC[C@]2([C@@H]1CC[C@@]3([C@@H]2CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CCC(C5(C)C)C)C)C)C)C
Structure:
CAS RN: 117783-53-6
CAS Name: 1-[2-[(2S)-2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenyl-1-propanone hydrochloride
OPENEYE Name: 1-[2-[(2S)-2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenyl-propan-1-one hydrochloride
IUPAC Name: 1-[2-[(2S)-2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenylpropan-1-one hydrochloride
SYSTEMATIC NAME: 1-[2-[(2S)-2-oxidanyl-3-(propylamino)propoxy]phenyl]-3-phenyl-propan-1-one hydrochloride
MOLECULAR FORMULA: C21H28ClNO3
MOLECULAR WEIGHT: 377.90492
SMILES: CCCNC[C@@H](COC1=CC=CC=C1C(=O)CCC2=CC=CC=C2)O.Cl
Structure:
CAS RN: 117782-63-5
CAS Name: 1-[2-[(2R)-2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenyl-1-propanone hydrochloride
OPENEYE Name: 1-[2-[(2R)-2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenyl-propan-1-one hydrochloride
IUPAC Name: 1-[2-[(2R)-2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenylpropan-1-one hydrochloride
SYSTEMATIC NAME: 1-[2-[(2R)-2-oxidanyl-3-(propylamino)propoxy]phenyl]-3-phenyl-propan-1-one hydrochloride
MOLECULAR FORMULA: C21H28ClNO3
MOLECULAR WEIGHT: 377.90492
SMILES: CCCNC[C@H](COC1=CC=CC=C1C(=O)CCC2=CC=CC=C2)O.Cl
Structure:
CAS RN: 117773-04-3
CAS Name: 1-[2-[(2R)-2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenyl-1-propanone
OPENEYE Name: 1-[2-[(2R)-2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenyl-propan-1-one
IUPAC Name: 1-[2-[(2R)-2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenylpropan-1-one
SYSTEMATIC NAME: 1-[2-[(2R)-2-oxidanyl-3-(propylamino)propoxy]phenyl]-3-phenyl-propan-1-one
MOLECULAR FORMULA: C21H27NO3
MOLECULAR WEIGHT: 341.44398
SMILES: CCCNC[C@H](COC1=CC=CC=C1C(=O)CCC2=CC=CC=C2)O
Structure:
CAS RN: 117667-25-1
CAS Name: 1-(4-tert-butylphenoxy)-3-(3-piperidinyl)-2-propanol
OPENEYE Name: 1-(4-tert-butylphenoxy)-3-(3-piperidyl)propan-2-ol
IUPAC Name: 1-(4-tert-butylphenoxy)-3-piperidin-3-ylpropan-2-ol
SYSTEMATIC NAME: 1-(4-tert-butylphenoxy)-3-piperidin-3-yl-propan-2-ol
MOLECULAR FORMULA: C18H29NO2
MOLECULAR WEIGHT: 291.42836
SMILES: CC(C)(C)C1=CC=C(C=C1)OCC(CC2CCCNC2)O
Structure:
CAS RN: 107258-87-7
CAS Name: cyclohexyl-(2-methoxyphenyl)methanone
OPENEYE Name: cyclohexyl-(2-methoxyphenyl)methanone
IUPAC Name: cyclohexyl-(2-methoxyphenyl)methanone
SYSTEMATIC NAME: cyclohexyl-(2-methoxyphenyl)methanone
MOLECULAR FORMULA: C14H18O2
MOLECULAR WEIGHT: 218.29152
SMILES: COC1=CC=CC=C1C(=O)C2CCCCC2
Structure:
CAS RN: 13889-96-8
CAS Name: (1S,6R,7R,8R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-1,6,7,8-tetrol
OPENEYE Name: (1S,6R,7R,8R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-1,6,7,8-tetrol
IUPAC Name: (1S,6R,7R,8R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-1,6,7,8-tetrol
SYSTEMATIC NAME: (1S,6R,7R,8R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-1,6,7,8-tetrol
MOLECULAR FORMULA: C8H15NO4
MOLECULAR WEIGHT: 189.209
SMILES: C1CN2C[C@H]([C@H]([C@@H]([C@H]2[C@H]1O)O)O)O
Structure:
CAS RN: 107244-34-8
CAS Name: (1S,6R,7R,8R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-1,6,7,8-tetrol
OPENEYE Name: (1S,6R,7R,8R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-1,6,7,8-tetrol
IUPAC Name: (1S,6R,7R,8R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-1,6,7,8-tetrol
SYSTEMATIC NAME: (1S,6R,7R,8R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-1,6,7,8-tetrol
MOLECULAR FORMULA: C8H15NO4
MOLECULAR WEIGHT: 189.209
SMILES: C1CN2C[C@H]([C@H]([C@@H]([C@H]2[C@H]1O)O)O)O
Structure:
CAS RN: 117591-51-2
CAS Name: 1,2-dibromo-3,4-dichlorodibenzo-p-dioxin
OPENEYE Name: 1,2-dibromo-3,4-dichloro-dibenzo-p-dioxin
IUPAC Name: 1,2-dibromo-3,4-dichlorodibenzo-p-dioxin
SYSTEMATIC NAME: 1,2-bis(bromanyl)-3,4-bis(chloranyl)dibenzo-p-dioxin
MOLECULAR FORMULA: C12H4Br2Cl2O2
MOLECULAR WEIGHT: 410.87296
SMILES: C1=CC=C2C(=C1)OC3=C(O2)C(=C(C(=C3Cl)Cl)Br)Br
Structure:
CAS RN: 117549-94-7
CAS Name: 1,2,3-tribromo-4,6,7,8,9-pentachlorodibenzo-p-dioxin
OPENEYE Name: 1,2,3-tribromo-4,6,7,8,9-pentachloro-dibenzo-p-dioxin
IUPAC Name: 1,2,3-tribromo-4,6,7,8,9-pentachlorodibenzo-p-dioxin
SYSTEMATIC NAME: 1,2,3-tris(bromanyl)-4,6,7,8,9-pentakis(chloranyl)dibenzo-p-dioxin
MOLECULAR FORMULA: C12Br3Cl5O2
MOLECULAR WEIGHT: 593.1042
SMILES: C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)OC3=C(O2)C(=C(C(=C3Br)Br)Br)Cl
Structure:
CAS RN: 117525-95-8
CAS Name: 2,3,4,6,7,8-hexabromo-1-chlorodibenzo-p-dioxin
OPENEYE Name: 2,3,4,6,7,8-hexabromo-1-chloro-dibenzo-p-dioxin
IUPAC Name: 2,3,4,6,7,8-hexabromo-1-chlorodibenzo-p-dioxin
SYSTEMATIC NAME: 2,3,4,6,7,8-hexakis(bromanyl)-1-chloranyl-dibenzo-p-dioxin
MOLECULAR FORMULA: C12HBr6ClO2
MOLECULAR WEIGHT: 692.01214
SMILES: C1=C2C(=C(C(=C1Br)Br)Br)OC3=C(O2)C(=C(C(=C3Br)Br)Br)Cl
Structure:
CAS RN: 81067-37-0
CAS Name: 1-bromo-2,3,4-trichlorobenzene
OPENEYE Name: 1-bromo-2,3,4-trichloro-benzene
IUPAC Name: 1-bromo-2,3,4-trichlorobenzene
SYSTEMATIC NAME: 1-bromanyl-2,3,4-tris(chloranyl)benzene
MOLECULAR FORMULA: C6H2BrCl3
MOLECULAR WEIGHT: 260.34308
SMILES: C1=CC(=C(C(=C1Cl)Cl)Cl)Br
Structure:
CAS RN: 107033-12-5
CAS Name: (1R,2R,3S,4R)-1-[[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-purinyl]amino]-1,2,3,4-tetrahydrobenzo[g]phenanthrene-2,3,4-triol
OPENEYE Name: (1R,2R,3S,4R)-1-[[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purin-6-yl]amino]-1,2,3,4-tetrahydrobenzo[g]phenanthrene-2,3,4-triol
IUPAC Name: (1R,2R,3S,4R)-1-[[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]-1,2,3,4-tetrahydrobenzo[g]phenanthrene-2,3,4-triol
SYSTEMATIC NAME: (1R,2R,3S,4R)-1-[[9-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]purin-6-yl]amino]-1,2,3,4-tetrahydrobenzo[g]phenanthrene-2,3,4-triol
MOLECULAR FORMULA: C28H27N5O6
MOLECULAR WEIGHT: 529.54388
SMILES: C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2N=CN=C3N[C@H]4[C@H]([C@H]([C@@H](C5=C4C6=C(C=CC7=CC=CC=C76)C=C5)O)O)O)CO)O
Structure:
CAS RN: 107033-09-0
CAS Name: (1S,2S,3R,4S)-1-[[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-purinyl]amino]-1,2,3,4-tetrahydrobenzo[g]phenanthrene-2,3,4-triol
OPENEYE Name: (1S,2S,3R,4S)-1-[[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purin-6-yl]amino]-1,2,3,4-tetrahydrobenzo[g]phenanthrene-2,3,4-triol
IUPAC Name: (1S,2S,3R,4S)-1-[[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]-1,2,3,4-tetrahydrobenzo[g]phenanthrene-2,3,4-triol
SYSTEMATIC NAME: (1S,2S,3R,4S)-1-[[9-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]purin-6-yl]amino]-1,2,3,4-tetrahydrobenzo[g]phenanthrene-2,3,4-triol
MOLECULAR FORMULA: C28H27N5O6
MOLECULAR WEIGHT: 529.54388
SMILES: C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2N=CN=C3N[C@@H]4[C@@H]([C@@H]([C@H](C5=C4C6=C(C=CC7=CC=CC=C76)C=C5)O)O)O)CO)O
Structure:
CAS RN: 25217-77-0
CAS Name: (1S,2S,3R,4S)-1-[[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-purinyl]amino]-1,2,3,4-tetrahydrobenzo[g]phenanthrene-2,3,4-triol
OPENEYE Name: (1S,2S,3R,4S)-1-[[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purin-6-yl]amino]-1,2,3,4-tetrahydrobenzo[g]phenanthrene-2,3,4-triol
IUPAC Name: (1S,2S,3R,4S)-1-[[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]-1,2,3,4-tetrahydrobenzo[g]phenanthrene-2,3,4-triol
SYSTEMATIC NAME: (1S,2S,3R,4S)-1-[[9-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]purin-6-yl]amino]-1,2,3,4-tetrahydrobenzo[g]phenanthrene-2,3,4-triol
MOLECULAR FORMULA: C28H27N5O6
MOLECULAR WEIGHT: 529.54388
SMILES: C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2N=CN=C3N[C@@H]4[C@@H]([C@@H]([C@H](C5=C4C6=C(C=CC7=CC=CC=C76)C=C5)O)O)O)CO)O
Structure:
CAS RN: 117417-71-7
CAS Name: 2-[4-[(4-tert-butylphenyl)-oxomethyl]phenoxy]acetic acid
OPENEYE Name: 2-[4-(4-tert-butylbenzoyl)phenoxy]acetic acid
IUPAC Name: 2-[4-(4-tert-butylbenzoyl)phenoxy]acetic acid
SYSTEMATIC NAME: 2-[4-(4-tert-butylphenyl)carbonylphenoxy]ethanoic acid
MOLECULAR FORMULA: C19H20O4
MOLECULAR WEIGHT: 312.3597
SMILES: CC(C)(C)C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OCC(=O)O
Structure:
CAS RN: 4786-51-0
CAS Name: (2S)-2-(chloroamino)-3-phenylpropanoic acid
OPENEYE Name: (2S)-2-(chloroamino)-3-phenyl-propanoic acid
IUPAC Name: (2S)-2-(chloroamino)-3-phenylpropanoic acid
SYSTEMATIC NAME: (2S)-2-(chloranylamino)-3-phenyl-propanoic acid
MOLECULAR FORMULA: C9H10ClNO2
MOLECULAR WEIGHT: 199.6342
SMILES: C1=CC=C(C=C1)C[C@@H](C(=O)O)NCl
Structure:
CAS RN: 117345-97-8
CAS Name: [4-chloro-5-(difluoromethoxy)-2-fluorophenyl]hydrazine
OPENEYE Name: [4-chloro-5-(difluoromethoxy)-2-fluoro-phenyl]hydrazine
IUPAC Name: [4-chloro-5-(difluoromethoxy)-2-fluorophenyl]hydrazine
SYSTEMATIC NAME: [5-[bis(fluoranyl)methoxy]-4-chloranyl-2-fluoranyl-phenyl]diazane
MOLECULAR FORMULA: C7H6ClF3N2O
MOLECULAR WEIGHT: 226.58355
SMILES: C1=C(C(=CC(=C1OC(F)F)Cl)F)NN
Structure:
CAS RN: 106969-06-6
CAS Name: 3-chloro-2-(2,4-dichloro-5-propan-2-yloxyphenyl)-4,5,6,7-tetrahydroindazole
OPENEYE Name: 3-chloro-2-(2,4-dichloro-5-isopropoxy-phenyl)-4,5,6,7-tetrahydroindazole
IUPAC Name: 3-chloro-2-(2,4-dichloro-5-propan-2-yloxyphenyl)-4,5,6,7-tetrahydroindazole
SYSTEMATIC NAME: 2-[2,4-bis(chloranyl)-5-propan-2-yloxy-phenyl]-3-chloranyl-4,5,6,7-tetrahydroindazole
MOLECULAR FORMULA: C16H17Cl3N2O
MOLECULAR WEIGHT: 359.67798
SMILES: CC(C)OC1=C(C=C(C(=C1)N2C(=C3CCCCC3=N2)Cl)Cl)Cl
Structure:
CAS RN: 117257-66-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H24N2O
MOLECULAR WEIGHT: 296.40666
SMILES: CCC12CCN3C(=CC4=CC=CC=C43)CCN(C1)C5C(C2)O5
Structure:
CAS RN: 117247-24-2
CAS Name: 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)acetic acid [1-cyanoethyl(dimethyl)silyl] ester
OPENEYE Name: [1-cyanoethyl(dimethyl)silyl] 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)acetate
IUPAC Name: [1-cyanoethyl(dimethyl)silyl] 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)acetate
SYSTEMATIC NAME: [1-cyanoethyl(dimethyl)silyl] 2-(4-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate
MOLECULAR FORMULA: C14H15ClN2O3SSi
MOLECULAR WEIGHT: 354.884
SMILES: CC(C#N)[Si](C)(C)OC(=O)CN1C2=C(C=CC=C2Cl)SC1=O
Structure:
CAS RN: 117241-62-0
CAS Name: 2-(2,4,5-trichlorophenoxy)acetic acid [1-cyanoethyl(dimethyl)silyl] ester
OPENEYE Name: [1-cyanoethyl(dimethyl)silyl] 2-(2,4,5-trichlorophenoxy)acetate
IUPAC Name: [1-cyanoethyl(dimethyl)silyl] 2-(2,4,5-trichlorophenoxy)acetate
SYSTEMATIC NAME: [1-cyanoethyl(dimethyl)silyl] 2-[2,4,5-tris(chloranyl)phenoxy]ethanoate
MOLECULAR FORMULA: C13H14Cl3NO3Si
MOLECULAR WEIGHT: 366.69966
SMILES: CC(C#N)[Si](C)(C)OC(=O)COC1=CC(=C(C=C1Cl)Cl)Cl
Structure:
CAS RN: 117233-46-2
CAS Name: 2-(3,4,5-trichlorophenoxy)propanoic acid [1-cyanoethyl(dimethyl)silyl] ester
OPENEYE Name: [1-cyanoethyl(dimethyl)silyl] 2-(3,4,5-trichlorophenoxy)propanoate
IUPAC Name: [1-cyanoethyl(dimethyl)silyl] 2-(3,4,5-trichlorophenoxy)propanoate
SYSTEMATIC NAME: [1-cyanoethyl(dimethyl)silyl] 2-[3,4,5-tris(chloranyl)phenoxy]propanoate
MOLECULAR FORMULA: C14H16Cl3NO3Si
MOLECULAR WEIGHT: 380.72624
SMILES: CC(C#N)[Si](C)(C)OC(=O)C(C)OC1=CC(=C(C(=C1)Cl)Cl)Cl
Structure:
CAS RN: 117233-43-9
CAS Name: 2-(2,4-dichloro-6-methylphenoxy)acetic acid [1-cyanoethyl(dimethyl)silyl] ester
OPENEYE Name: [1-cyanoethyl(dimethyl)silyl] 2-(2,4-dichloro-6-methyl-phenoxy)acetate
IUPAC Name: [1-cyanoethyl(dimethyl)silyl] 2-(2,4-dichloro-6-methylphenoxy)acetate
SYSTEMATIC NAME: [1-cyanoethyl(dimethyl)silyl] 2-[2,4-bis(chloranyl)-6-methyl-phenoxy]ethanoate
MOLECULAR FORMULA: C14H17Cl2NO3Si
MOLECULAR WEIGHT: 346.28118
SMILES: CC1=CC(=CC(=C1OCC(=O)O[Si](C)(C)C(C)C#N)Cl)Cl
Structure:
CAS RN: 117233-42-8
CAS Name: 2-(3,4-dichlorophenoxy)acetic acid [1-cyanoethyl(dimethyl)silyl] ester
OPENEYE Name: [1-cyanoethyl(dimethyl)silyl] 2-(3,4-dichlorophenoxy)acetate
IUPAC Name: [1-cyanoethyl(dimethyl)silyl] 2-(3,4-dichlorophenoxy)acetate
SYSTEMATIC NAME: [1-cyanoethyl(dimethyl)silyl] 2-[3,4-bis(chloranyl)phenoxy]ethanoate
MOLECULAR FORMULA: C13H15Cl2NO3Si
MOLECULAR WEIGHT: 332.2546
SMILES: CC(C#N)[Si](C)(C)OC(=O)COC1=CC(=C(C=C1)Cl)Cl
Structure:
CAS RN: 117233-41-7
CAS Name: 2-(1-naphthalenyl)acetic acid [1-cyanoethyl(dimethyl)silyl] ester
OPENEYE Name: [1-cyanoethyl(dimethyl)silyl] 2-(1-naphthyl)acetate
IUPAC Name: [1-cyanoethyl(dimethyl)silyl] 2-naphthalen-1-ylacetate
SYSTEMATIC NAME: [1-cyanoethyl(dimethyl)silyl] 2-naphthalen-1-ylethanoate
MOLECULAR FORMULA: C17H19NO2Si
MOLECULAR WEIGHT: 297.42376
SMILES: CC(C#N)[Si](C)(C)OC(=O)CC1=CC=CC2=CC=CC=C21
Structure:
CAS RN: 117205-69-3
CAS Name: 2-(2,6-dichlorophenoxy)acetic acid [1-cyanoethyl(dimethyl)silyl] ester
OPENEYE Name: [1-cyanoethyl(dimethyl)silyl] 2-(2,6-dichlorophenoxy)acetate
IUPAC Name: [1-cyanoethyl(dimethyl)silyl] 2-(2,6-dichlorophenoxy)acetate
SYSTEMATIC NAME: [1-cyanoethyl(dimethyl)silyl] 2-[2,6-bis(chloranyl)phenoxy]ethanoate
MOLECULAR FORMULA: C13H15Cl2NO3Si
MOLECULAR WEIGHT: 332.2546
SMILES: CC(C#N)[Si](C)(C)OC(=O)COC1=C(C=CC=C1Cl)Cl
Structure:
CAS RN: 117197-09-8
CAS Name: 2-(2,4-dichlorophenoxy)propanoic acid [1-cyanoethyl(dimethyl)silyl] ester
OPENEYE Name: [1-cyanoethyl(dimethyl)silyl] 2-(2,4-dichlorophenoxy)propanoate
IUPAC Name: [1-cyanoethyl(dimethyl)silyl] 2-(2,4-dichlorophenoxy)propanoate
SYSTEMATIC NAME: [1-cyanoethyl(dimethyl)silyl] 2-[2,4-bis(chloranyl)phenoxy]propanoate
MOLECULAR FORMULA: C14H17Cl2NO3Si
MOLECULAR WEIGHT: 346.28118
SMILES: CC(C#N)[Si](C)(C)OC(=O)C(C)OC1=C(C=C(C=C1)Cl)Cl
Structure:
CAS RN: 1171-92-2
CAS Name: 2,3,6-trichlorobenzoic acid [1-cyanoethyl(dimethyl)silyl] ester
OPENEYE Name: [1-cyanoethyl(dimethyl)silyl] 2,3,6-trichlorobenzoate
IUPAC Name: [1-cyanoethyl(dimethyl)silyl] 2,3,6-trichlorobenzoate
SYSTEMATIC NAME: [1-cyanoethyl(dimethyl)silyl] 2,3,6-tris(chloranyl)benzoate
MOLECULAR FORMULA: C12H12Cl3NO2Si
MOLECULAR WEIGHT: 336.67368
SMILES: CC(C#N)[Si](C)(C)OC(=O)C1=C(C=CC(=C1Cl)Cl)Cl
Structure:
CAS RN: 1171-90-0
CAS Name: 3,6-dichloro-2-methoxybenzoic acid [1-cyanoethyl(dimethyl)silyl] ester
OPENEYE Name: [1-cyanoethyl(dimethyl)silyl] 3,6-dichloro-2-methoxy-benzoate
IUPAC Name: [1-cyanoethyl(dimethyl)silyl] 3,6-dichloro-2-methoxybenzoate
SYSTEMATIC NAME: [1-cyanoethyl(dimethyl)silyl] 3,6-bis(chloranyl)-2-methoxy-benzoate
MOLECULAR FORMULA: C13H15Cl2NO3Si
MOLECULAR WEIGHT: 332.2546
SMILES: CC(C#N)[Si](C)(C)OC(=O)C1=C(C=CC(=C1OC)Cl)Cl
Structure:
CAS RN: 117186-54-6
CAS Name: 2-(4-chloro-2-methylphenoxy)propanoic acid [1-cyanoethyl(dimethyl)silyl] ester
OPENEYE Name: [1-cyanoethyl(dimethyl)silyl] 2-(4-chloro-2-methyl-phenoxy)propanoate
IUPAC Name: [1-cyanoethyl(dimethyl)silyl] 2-(4-chloro-2-methylphenoxy)propanoate
SYSTEMATIC NAME: [1-cyanoethyl(dimethyl)silyl] 2-(4-chloranyl-2-methyl-phenoxy)propanoate
MOLECULAR FORMULA: C15H20ClNO3Si
MOLECULAR WEIGHT: 325.8627
SMILES: CC1=C(C=CC(=C1)Cl)OC(C)C(=O)O[Si](C)(C)C(C)C#N
Structure:
CAS RN: 117177-14-7
CAS Name: (2S,3S,4S,5R,6S)-5-[[[(2R,3S,4R,5R)-5-(2,4-dioxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4,6-trihydroxy-2-oxanecarboxylic acid
OPENEYE Name: (2S,3S,4S,5R,6S)-5-[[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-3,4,6-trihydroxy-tetrahydropyran-2-carboxylic acid
IUPAC Name: (2S,3S,4S,5R,6S)-5-[[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4,6-trihydroxyoxane-2-carboxylic acid
SYSTEMATIC NAME: (2S,3S,4S,5R,6S)-5-[[[(2R,3S,4R,5R)-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-3,4,6-tris(oxidanyl)oxane-2-carboxylic acid
MOLECULAR FORMULA: C15H22N2O18P2
MOLECULAR WEIGHT: 580.285302
SMILES: C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)O[C@@H]3[C@H]([C@@H]([C@H](O[C@@H]3O)C(=O)O)O)O)O)O
Structure:
CAS RN: 117075-43-1
CAS Name: (3-ethoxyphenyl)-dimethyl-[(3-phenoxyphenyl)methoxymethyl]silane
OPENEYE Name: (3-ethoxyphenyl)-dimethyl-[(3-phenoxyphenyl)methoxymethyl]silane
IUPAC Name: (3-ethoxyphenyl)-dimethyl-[(3-phenoxyphenyl)methoxymethyl]silane
SYSTEMATIC NAME: (3-ethoxyphenyl)-dimethyl-[(3-phenoxyphenyl)methoxymethyl]silane
MOLECULAR FORMULA: C24H28O3Si
MOLECULAR WEIGHT: 392.56282
SMILES: CCOC1=CC(=CC=C1)[Si](C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3
Structure:
CAS RN: 117020-58-3
CAS Name: chloromethyl-(4-ethoxyphenyl)-dimethylsilane
OPENEYE Name: chloromethyl-(4-ethoxyphenyl)-dimethyl-silane
IUPAC Name: chloromethyl-(4-ethoxyphenyl)-dimethylsilane
SYSTEMATIC NAME: chloromethyl-(4-ethoxyphenyl)-dimethyl-silane
MOLECULAR FORMULA: C11H17ClOSi
MOLECULAR WEIGHT: 228.79058
SMILES: CCOC1=CC=C(C=C1)[Si](C)(C)CCl
Structure:
CAS RN: 117020-20-9
CAS Name: [4-(difluoromethoxy)phenyl]-dimethyl-[(3-phenoxyphenyl)methoxymethyl]silane
OPENEYE Name: [4-(difluoromethoxy)phenyl]-dimethyl-[(3-phenoxyphenyl)methoxymethyl]silane
IUPAC Name: [4-(difluoromethoxy)phenyl]-dimethyl-[(3-phenoxyphenyl)methoxymethyl]silane
SYSTEMATIC NAME: [4-[bis(fluoranyl)methoxy]phenyl]-dimethyl-[(3-phenoxyphenyl)methoxymethyl]silane
MOLECULAR FORMULA: C23H24F2O3Si
MOLECULAR WEIGHT: 414.517166
SMILES: C[Si](C)(COCC1=CC(=CC=C1)OC2=CC=CC=C2)C3=CC=C(C=C3)OC(F)F
Structure:
CAS RN: 117019-87-1
CAS Name: [4-(ethylthio)phenyl]-dimethyl-[(3-phenoxyphenyl)methoxymethyl]silane
OPENEYE Name: (4-ethylsulfanylphenyl)-dimethyl-[(3-phenoxyphenyl)methoxymethyl]silane
IUPAC Name: (4-ethylsulfanylphenyl)-dimethyl-[(3-phenoxyphenyl)methoxymethyl]silane
SYSTEMATIC NAME: (4-ethylsulfanylphenyl)-dimethyl-[(3-phenoxyphenyl)methoxymethyl]silane
MOLECULAR FORMULA: C24H28O2SSi
MOLECULAR WEIGHT: 408.62842
SMILES: CCSC1=CC=C(C=C1)[Si](C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3
Structure:
No comments:
Post a Comment