CAS RN: 105878-27-1
CAS Name: niobium; 2,4,6-trihydroxy-1,3,5-trioxa-2$l^{5},4$l^{5},6$l^{5}-triniobacyclohexane 2,4,6-trioxide
OPENEYE Name: niobium; 2,4,6-trihydroxy-1,3,5-trioxa-2$l^{5},4$l^{5},6$l^{5}-triniobacyclohexane 2,4,6-trioxide
IUPAC Name: niobium; 2,4,6-trihydroxy-1,3,5-trioxa-2$l^{5},4$l^{5},6$l^{5}-triniobacyclohexane 2,4,6-trioxide
SYSTEMATIC NAME: niobium; 2,4,6-tris(oxidanyl)-1,3,5-trioxa-2$l^{5},4$l^{5},6$l^{5}-triniobacyclohexane 2,4,6-trioxide
MOLECULAR FORMULA: H3Nb4O9
MOLECULAR WEIGHT: 518.64394
SMILES: O[Nb]1(=O)O[Nb](=O)(O[Nb](=O)(O1)O)O.[Nb]
Structure:
CAS RN: 105878-26-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: Nb4O10
MOLECULAR WEIGHT: 531.61952
SMILES: O=[Nb]12O[Nb]3(=O)O[Nb](=O)(O1)O[Nb](=O)(O2)O3
Structure:
CAS RN: 105442-63-5
CAS Name: 1-(ethenyltelluro)butane
OPENEYE Name: 1-vinyltellanylbutane
IUPAC Name: 1-ethenyltellanylbutane
SYSTEMATIC NAME: 1-ethenyltellanylbutane
MOLECULAR FORMULA: C6H12Te
MOLECULAR WEIGHT: 211.75948
SMILES: CCCC[Te]C=C
Structure:
CAS RN: 105442-62-4
CAS Name: 2-(ethenyltelluro)propane
OPENEYE Name: 2-vinyltellanylpropane
IUPAC Name: 2-ethenyltellanylpropane
SYSTEMATIC NAME: 2-ethenyltellanylpropane
MOLECULAR FORMULA: C5H10Te
MOLECULAR WEIGHT: 197.7329
SMILES: CC(C)[Te]C=C
Structure:
CAS RN: 105386-85-4
CAS Name: 1-[6-[bis(2-hydroxy-3-phenoxypropyl)amino]hexyl-(2-hydroxy-3-phenoxypropyl)amino]-3-phenoxy-2-propanol
OPENEYE Name: 1-[6-[bis(2-hydroxy-3-phenoxy-propyl)amino]hexyl-(2-hydroxy-3-phenoxy-propyl)amino]-3-phenoxy-propan-2-ol
IUPAC Name: 1-[6-[bis(2-hydroxy-3-phenoxypropyl)amino]hexyl-(2-hydroxy-3-phenoxypropyl)amino]-3-phenoxypropan-2-ol
SYSTEMATIC NAME: 1-[6-[bis(2-oxidanyl-3-phenoxy-propyl)amino]hexyl-(2-oxidanyl-3-phenoxy-propyl)amino]-3-phenoxy-propan-2-ol
MOLECULAR FORMULA: C42H56N2O8
MOLECULAR WEIGHT: 716.90264
SMILES: C1=CC=C(C=C1)OCC(CN(CCCCCCN(CC(COC2=CC=CC=C2)O)CC(COC3=CC=CC=C3)O)CC(COC4=CC=CC=C4)O)O
Structure:
CAS RN: 105311-66-8
CAS Name: 1,2,3,3,4-pentafluoro-4-(trifluoromethyl)cyclobutene
OPENEYE Name: 1,2,3,3,4-pentafluoro-4-(trifluoromethyl)cyclobutene
IUPAC Name: 1,2,3,3,4-pentafluoro-4-(trifluoromethyl)cyclobutene
SYSTEMATIC NAME: 1,2,3,3,4-pentakis(fluoranyl)-4-(trifluoromethyl)cyclobutene
MOLECULAR FORMULA: C5F8
MOLECULAR WEIGHT: 212.040726
SMILES: C1(=C(C(C1(C(F)(F)F)F)(F)F)F)F
Structure:
CAS RN: 105184-38-1
CAS Name: 2-(3,5-difluorophenyl)acetic acid
OPENEYE Name: 2-(3,5-difluorophenyl)acetic acid
IUPAC Name: 2-(3,5-difluorophenyl)acetic acid
SYSTEMATIC NAME: 2-[3,5-bis(fluoranyl)phenyl]ethanoic acid
MOLECULAR FORMULA: C8H6F2O2
MOLECULAR WEIGHT: 172.128846
SMILES: C1=C(C=C(C=C1F)F)CC(=O)O
Structure:
CAS RN: 105090-34-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H16N2
MOLECULAR WEIGHT: 164.24744
SMILES: C1CC2CC1N3N2C4CCC3C4
Structure:
CAS RN: 104968-58-3
CAS Name: 1-isothiocyanato-3,5-dimethoxybenzene
OPENEYE Name: 1-isothiocyanato-3,5-dimethoxy-benzene
IUPAC Name: 1-isothiocyanato-3,5-dimethoxybenzene
SYSTEMATIC NAME: 1-isothiocyanato-3,5-dimethoxy-benzene
MOLECULAR FORMULA: C9H9NO2S
MOLECULAR WEIGHT: 195.23826
SMILES: COC1=CC(=CC(=C1)N=C=S)OC
Structure:
CAS RN: 104910-78-3
CAS Name: hexa-1,5-diene-3,4-dione
OPENEYE Name: hexa-1,5-diene-3,4-dione
IUPAC Name: hexa-1,5-diene-3,4-dione
SYSTEMATIC NAME: hexa-1,5-diene-3,4-dione
MOLECULAR FORMULA: C6H6O2
MOLECULAR WEIGHT: 110.11064
SMILES: C=CC(=O)C(=O)C=C
Structure:
CAS RN: 104857-88-7
CAS Name: 4,4,5,5,5-pentafluoro-3-oxopentanoic acid methyl ester
OPENEYE Name: methyl 4,4,5,5,5-pentafluoro-3-oxo-pentanoate
IUPAC Name: methyl 4,4,5,5,5-pentafluoro-3-oxopentanoate
SYSTEMATIC NAME: methyl 4,4,5,5,5-pentakis(fluoranyl)-3-oxidanylidene-pentanoate
MOLECULAR FORMULA: C6H5F5O3
MOLECULAR WEIGHT: 220.094116
SMILES: COC(=O)CC(=O)C(C(F)(F)F)(F)F
Structure:
CAS RN: 104728-29-2
CAS Name: 1,3-dibutyl-2-ethyl-4,5-dimethyl-1,3,2$l^{5}-diazaphosphole 2-oxide
OPENEYE Name: 1,3-dibutyl-2-ethyl-4,5-dimethyl-1,3,2$l^{5}-diazaphosphole 2-oxide
IUPAC Name: 1,3-dibutyl-2-ethyl-4,5-dimethyl-1,3,2$l^{5}-diazaphosphole 2-oxide
SYSTEMATIC NAME: 1,3-dibutyl-2-ethyl-4,5-dimethyl-1,3,2$l^{5}-diazaphosphole 2-oxide
MOLECULAR FORMULA: C14H29N2OP
MOLECULAR WEIGHT: 272.366621
SMILES: CCCCN1C(=C(N(P1(=O)CC)CCCC)C)C
Structure:
CAS RN: 104713-91-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H12O2
MOLECULAR WEIGHT: 236.26528
SMILES: C1C2=CC=CC=C(C2=O)CC3=CC=CC=C1C3=O
Structure:
CAS RN: 104713-92-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H12O2
MOLECULAR WEIGHT: 236.26528
SMILES: C1C2=CC=CC=C(C2=O)CC3=CC=CC=C1C3=O
Structure:
CAS RN: 104598-81-4
CAS Name: 9-methylene-1,4-dioxaspiro[4.5]decane
OPENEYE Name: 9-methylene-1,4-dioxaspiro[4.5]decane
IUPAC Name: 9-methylidene-1,4-dioxaspiro[4.5]decane
SYSTEMATIC NAME: 9-methylidene-1,4-dioxaspiro[4.5]decane
MOLECULAR FORMULA: C9H14O2
MOLECULAR WEIGHT: 154.20626
SMILES: C=C1CCCC2(C1)OCCO2
Structure:
CAS RN: 104598-80-3
CAS Name: 1,1-dimethoxy-3-methylenecyclohexane
OPENEYE Name: 1,1-dimethoxy-3-methylene-cyclohexane
IUPAC Name: 1,1-dimethoxy-3-methylidenecyclohexane
SYSTEMATIC NAME: 1,1-dimethoxy-3-methylidene-cyclohexane
MOLECULAR FORMULA: C9H16O2
MOLECULAR WEIGHT: 156.22214
SMILES: COC1(CCCC(=C)C1)OC
Structure:
CAS RN: 104013-09-4
CAS Name: 2-ethenyl-3-bicyclo[2.2.1]hept-5-enol
OPENEYE Name: 2-vinylbicyclo[2.2.1]hept-5-en-3-ol
IUPAC Name: 2-ethenylbicyclo[2.2.1]hept-5-en-3-ol
SYSTEMATIC NAME: 2-ethenylbicyclo[2.2.1]hept-5-en-3-ol
MOLECULAR FORMULA: C9H12O
MOLECULAR WEIGHT: 136.19098
SMILES: C=CC1C2CC(C1O)C=C2
Structure:
CAS RN: 103905-52-8
CAS Name: 2-but-1-en-3-ynol
OPENEYE Name: but-1-en-3-yn-2-ol
IUPAC Name: but-1-en-3-yn-2-ol
SYSTEMATIC NAME: but-1-en-3-yn-2-ol
MOLECULAR FORMULA: C4H4O
MOLECULAR WEIGHT: 68.07396
SMILES: C=C(C#C)O
Structure:
CAS RN: 103678-18-8
CAS Name: N1,N1,N1',N1',N3,N3,N3',N3'-octamethyl-1$l^{5},3$l^{5}-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine
OPENEYE Name: N1,N1,N1',N1',N3,N3,N3',N3'-octamethyl-1$l^{5},3$l^{5}-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine
IUPAC Name: 1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethyl-1$l^{5},3$l^{5}-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine
SYSTEMATIC NAME: N1,N1,N1',N1',N3,N3,N3',N3'-octamethyl-1$l^{5},3$l^{5}-diphosphacyclobuta-1,3-diene-1,1,3,3-tetramine
MOLECULAR FORMULA: C10H26N4P2
MOLECULAR WEIGHT: 264.287762
SMILES: CN(C)P1(=CP(=C1)(N(C)C)N(C)C)N(C)C
Structure:
CAS RN: 103582-51-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H14O
MOLECULAR WEIGHT: 150.21756
SMILES: CC(=C1C2CC3C1C3C2)OC
Structure:
CAS RN: 103582-50-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H14O
MOLECULAR WEIGHT: 150.21756
SMILES: COC(=C)C1C2CC3C1C3C2
Structure:
CAS RN: 103582-48-5
CAS Name: 5-(1-methoxyethylidene)bicyclo[2.2.1]hept-2-ene
OPENEYE Name: 5-(1-methoxyethylidene)bicyclo[2.2.1]hept-2-ene
IUPAC Name: 5-(1-methoxyethylidene)bicyclo[2.2.1]hept-2-ene
SYSTEMATIC NAME: 5-(1-methoxyethylidene)bicyclo[2.2.1]hept-2-ene
MOLECULAR FORMULA: C10H14O
MOLECULAR WEIGHT: 150.21756
SMILES: CC(=C1CC2CC1C=C2)OC
Structure:
CAS RN: 103582-46-3
CAS Name: 5-(1-methoxyethenyl)bicyclo[2.2.1]hept-2-ene
OPENEYE Name: 5-(1-methoxyvinyl)bicyclo[2.2.1]hept-2-ene
IUPAC Name: 5-(1-methoxyethenyl)bicyclo[2.2.1]hept-2-ene
SYSTEMATIC NAME: 5-(1-methoxyethenyl)bicyclo[2.2.1]hept-2-ene
MOLECULAR FORMULA: C10H14O
MOLECULAR WEIGHT: 150.21756
SMILES: COC(=C)C1CC2CC1C=C2
Structure:
CAS RN: 103582-42-9
CAS Name: 3-(1-methoxyethenyl)bicyclo[2.2.1]heptane
OPENEYE Name: 2-(1-methoxyvinyl)norbornane
IUPAC Name: 3-(1-methoxyethenyl)bicyclo[2.2.1]heptane
SYSTEMATIC NAME: 3-(1-methoxyethenyl)bicyclo[2.2.1]heptane
MOLECULAR FORMULA: C10H16O
MOLECULAR WEIGHT: 152.23344
SMILES: COC(=C)C1CC2CCC1C2
Structure:
CAS RN: 103549-37-7
CAS Name: 3-methoxy-1-adamantanecarboxylic acid methyl ester
OPENEYE Name: methyl 3-methoxyadamantane-1-carboxylate
IUPAC Name: methyl 3-methoxyadamantane-1-carboxylate
SYSTEMATIC NAME: methyl 3-methoxyadamantane-1-carboxylate
MOLECULAR FORMULA: C13H20O3
MOLECULAR WEIGHT: 224.2961
SMILES: COC(=O)C12CC3CC(C1)CC(C3)(C2)OC
Structure:
CAS RN: 103549-36-6
CAS Name: 2-methoxy-1-adamantanecarboxylic acid methyl ester
OPENEYE Name: methyl 2-methoxyadamantane-1-carboxylate
IUPAC Name: methyl 2-methoxyadamantane-1-carboxylate
SYSTEMATIC NAME: methyl 2-methoxyadamantane-1-carboxylate
MOLECULAR FORMULA: C13H20O3
MOLECULAR WEIGHT: 224.2961
SMILES: COC1C2CC3CC(C2)CC1(C3)C(=O)OC
Structure:
CAS RN: 103549-35-5
CAS Name: 3-chloro-1-adamantanecarboxylic acid methyl ester
OPENEYE Name: methyl 3-chloroadamantane-1-carboxylate
IUPAC Name: methyl 3-chloroadamantane-1-carboxylate
SYSTEMATIC NAME: methyl 3-chloranyladamantane-1-carboxylate
MOLECULAR FORMULA: C12H17ClO2
MOLECULAR WEIGHT: 228.71518
SMILES: COC(=O)C12CC3CC(C1)CC(C3)(C2)Cl
Structure:
CAS RN: 103549-34-4
CAS Name: 2-chloro-1-adamantanecarboxylic acid methyl ester
OPENEYE Name: methyl 2-chloroadamantane-1-carboxylate
IUPAC Name: methyl 2-chloroadamantane-1-carboxylate
SYSTEMATIC NAME: methyl 2-chloranyladamantane-1-carboxylate
MOLECULAR FORMULA: C12H17ClO2
MOLECULAR WEIGHT: 228.71518
SMILES: COC(=O)C12CC3CC(C1)CC(C3)C2Cl
Structure:
CAS RN: 103547-55-3
CAS Name: 2-[amino(tert-butyl)boranyl]-2-methylpropane
OPENEYE Name: 2-[amino(tert-butyl)boranyl]-2-methyl-propane
IUPAC Name: 2-[amino(tert-butyl)boranyl]-2-methylpropane
SYSTEMATIC NAME: 2-[azanyl(tert-butyl)boranyl]-2-methyl-propane
MOLECULAR FORMULA: C8H20BN
MOLECULAR WEIGHT: 141.0621
SMILES: B(C(C)(C)C)(C(C)(C)C)N
Structure:
CAS RN: 103434-09-9
CAS Name: 4-isocyanobicyclo[2.2.1]heptane
OPENEYE Name: 1-isocyanonorbornane
IUPAC Name: 4-isocyanobicyclo[2.2.1]heptane
SYSTEMATIC NAME: 4-isocyanobicyclo[2.2.1]heptane
MOLECULAR FORMULA: C8H11N
MOLECULAR WEIGHT: 121.17964
SMILES: [C-]#[N+]C12CCC(C1)CC2
Structure:
CAS RN: 103225-43-0
CAS Name: 1,1-dioxo-2,6-diphenyl-4-thianone
OPENEYE Name: 1,1-dioxo-2,6-diphenyl-thian-4-one
IUPAC Name: 1,1-dioxo-2,6-diphenylthian-4-one
SYSTEMATIC NAME: 1,1-bis(oxidanylidene)-2,6-diphenyl-thian-4-one
MOLECULAR FORMULA: C17H16O3S
MOLECULAR WEIGHT: 300.37214
SMILES: C1C(S(=O)(=O)C(CC1=O)C2=CC=CC=C2)C3=CC=CC=C3
Structure:
CAS RN: 103185-26-8
CAS Name: 1-(3,3-dimethylbut-1-ynyl)adamantane
OPENEYE Name: 1-(3,3-dimethylbut-1-ynyl)adamantane
IUPAC Name: 1-(3,3-dimethylbut-1-ynyl)adamantane
SYSTEMATIC NAME: 1-(3,3-dimethylbut-1-ynyl)adamantane
MOLECULAR FORMULA: C16H24
MOLECULAR WEIGHT: 216.36176
SMILES: CC(C)(C)C#CC12CC3CC(C1)CC(C3)C2
Structure:
CAS RN: 103021-44-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H14N2
MOLECULAR WEIGHT: 162.23156
SMILES: C1C2C3CN4C2C5C1C3CN5C4
Structure:
CAS RN: 103021-43-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C11H18N2
MOLECULAR WEIGHT: 178.27402
SMILES: CN1CC2C3C1C4C(C3)C2CN4C
Structure:
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