CAS RN: 102504-20-1
CAS Name: 4,4-dimethyl-8-(phenylmethyl)-3-oxa-8-azaspiro[4.5]decan-2-one
OPENEYE Name: 8-benzyl-4,4-dimethyl-3-oxa-8-azaspiro[4.5]decan-2-one
IUPAC Name: 8-benzyl-4,4-dimethyl-3-oxa-8-azaspiro[4.5]decan-2-one
SYSTEMATIC NAME: 4,4-dimethyl-8-(phenylmethyl)-3-oxa-8-azaspiro[4.5]decan-2-one
MOLECULAR FORMULA: C17H23NO2
MOLECULAR WEIGHT: 273.37002
SMILES: CC1(C2(CCN(CC2)CC3=CC=CC=C3)CC(=O)O1)C
Structure:
CAS RN: 102395-53-9
CAS Name: 2-butan-2-yl-8-[4-(4-fluorophenyl)-4-oxobutyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one hydrochloride
OPENEYE Name: 8-[4-(4-fluorophenyl)-4-oxo-butyl]-4-phenyl-2-sec-butyl-2,4,8-triazaspiro[4.5]decan-1-one hydrochloride
IUPAC Name: 2-butan-2-yl-8-[4-(4-fluorophenyl)-4-oxobutyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one hydrochloride
SYSTEMATIC NAME: 2-butan-2-yl-8-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one hydrochloride
MOLECULAR FORMULA: C27H35ClFN3O2
MOLECULAR WEIGHT: 488.037103
SMILES: CCC(C)N1CN(C2(C1=O)CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4.Cl
Structure:
CAS RN: 92956-10-0
CAS Name: 2-cyclohexyl-2-hydroxy-3-pentynoic acid 3-(dimethylamino)propyl ester
OPENEYE Name: 3-(dimethylamino)propyl 2-cyclohexyl-2-hydroxy-pent-3-ynoate
IUPAC Name: 3-(dimethylamino)propyl 2-cyclohexyl-2-hydroxypent-3-ynoate
SYSTEMATIC NAME: 3-(dimethylamino)propyl 2-cyclohexyl-2-oxidanyl-pent-3-ynoate
MOLECULAR FORMULA: C16H27NO3
MOLECULAR WEIGHT: 281.39048
SMILES: CC#CC(C1CCCCC1)(C(=O)OCCCN(C)C)O
Structure:
CAS RN: 92956-00-8
CAS Name: 2-cyclopentyl-2-hydroxy-3-pentynoic acid (2-methyl-1-azabicyclo[2.2.2]octan-3-yl) ester
OPENEYE Name: (2-methylquinuclidin-3-yl) 2-cyclopentyl-2-hydroxy-pent-3-ynoate
IUPAC Name: (2-methyl-1-azabicyclo[2.2.2]octan-3-yl) 2-cyclopentyl-2-hydroxypent-3-ynoate
SYSTEMATIC NAME: (2-methyl-1-azabicyclo[2.2.2]octan-3-yl) 2-cyclopentyl-2-oxidanyl-pent-3-ynoate
MOLECULAR FORMULA: C18H27NO3
MOLECULAR WEIGHT: 305.41188
SMILES: CC#CC(C1CCCC1)(C(=O)OC2C(N3CCC2CC3)C)O
Structure:
CAS RN: 92956-01-9
CAS Name: 2-cyclopentyl-2-hydroxy-3-pentynoic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester
OPENEYE Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-cyclopentyl-2-hydroxy-pent-3-ynoate
IUPAC Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-cyclopentyl-2-hydroxypent-3-ynoate
SYSTEMATIC NAME: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-cyclopentyl-2-oxidanyl-pent-3-ynoate
MOLECULAR FORMULA: C18H27NO3
MOLECULAR WEIGHT: 305.41188
SMILES: CC#CC(C1CCCC1)(C(=O)OC2CC3CCC(C2)N3C)O
Structure:
CAS RN: 92956-67-7
CAS Name: 2-hydroxy-2-propan-2-yl-3-pentynoic acid (1-methyl-4-piperidinyl) ester
OPENEYE Name: (1-methyl-4-piperidyl) 2-hydroxy-2-isopropyl-pent-3-ynoate
IUPAC Name: (1-methylpiperidin-4-yl) 2-hydroxy-2-propan-2-ylpent-3-ynoate
SYSTEMATIC NAME: (1-methylpiperidin-4-yl) 2-oxidanyl-2-propan-2-yl-pent-3-ynoate
MOLECULAR FORMULA: C14H23NO3
MOLECULAR WEIGHT: 253.33732
SMILES: CC#CC(C(C)C)(C(=O)OC1CCN(CC1)C)O
Structure:
CAS RN: 92956-75-7
CAS Name: 2-cyclohexyl-2-hydroxy-3-heptynoic acid (1-methyl-4-piperidinyl) ester
OPENEYE Name: (1-methyl-4-piperidyl) 2-cyclohexyl-2-hydroxy-hept-3-ynoate
IUPAC Name: (1-methylpiperidin-4-yl) 2-cyclohexyl-2-hydroxyhept-3-ynoate
SYSTEMATIC NAME: (1-methylpiperidin-4-yl) 2-cyclohexyl-2-oxidanyl-hept-3-ynoate
MOLECULAR FORMULA: C19H31NO3
MOLECULAR WEIGHT: 321.45434
SMILES: CCCC#CC(C1CCCCC1)(C(=O)OC2CCN(CC2)C)O
Structure:
CAS RN: 92956-70-2
CAS Name: 2-cyclopentyl-2-hydroxy-5-methylhex-5-en-3-ynoic acid (1-methyl-4-piperidinyl) ester
OPENEYE Name: (1-methyl-4-piperidyl) 2-cyclopentyl-2-hydroxy-5-methyl-hex-5-en-3-ynoate
IUPAC Name: (1-methylpiperidin-4-yl) 2-cyclopentyl-2-hydroxy-5-methylhex-5-en-3-ynoate
SYSTEMATIC NAME: (1-methylpiperidin-4-yl) 2-cyclopentyl-5-methyl-2-oxidanyl-hex-5-en-3-ynoate
MOLECULAR FORMULA: C18H27NO3
MOLECULAR WEIGHT: 305.41188
SMILES: CC(=C)C#CC(C1CCCC1)(C(=O)OC2CCN(CC2)C)O
Structure:
CAS RN: 102504-74-5
CAS Name: 8-[4-(4-fluorophenyl)-4-oxobutyl]-4-phenyl-2-propan-2-yl-2,4,8-triazaspiro[4.5]decan-1-one hydrochloride
OPENEYE Name: 8-[4-(4-fluorophenyl)-4-oxo-butyl]-2-isopropyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one hydrochloride
IUPAC Name: 8-[4-(4-fluorophenyl)-4-oxobutyl]-4-phenyl-2-propan-2-yl-2,4,8-triazaspiro[4.5]decan-1-one hydrochloride
SYSTEMATIC NAME: 8-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]-4-phenyl-2-propan-2-yl-2,4,8-triazaspiro[4.5]decan-1-one hydrochloride
MOLECULAR FORMULA: C26H33ClFN3O2
MOLECULAR WEIGHT: 474.010523
SMILES: CC(C)N1CN(C2(C1=O)CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4.Cl
Structure:
CAS RN: 94685-92-4
CAS Name: 3-[1-(4-oxo-4-thiophen-2-ylbutyl)-3,6-dihydro-2H-pyridin-4-yl]-1H-benzimidazol-2-one
OPENEYE Name: 3-[1-[4-oxo-4-(2-thienyl)butyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-benzimidazol-2-one
IUPAC Name: 3-[1-(4-oxo-4-thiophen-2-ylbutyl)-3,6-dihydro-2H-pyridin-4-yl]-1H-benzimidazol-2-one
SYSTEMATIC NAME: 3-[1-(4-oxidanylidene-4-thiophen-2-yl-butyl)-3,6-dihydro-2H-pyridin-4-yl]-1H-benzimidazol-2-one
MOLECULAR FORMULA: C20H21N3O2S
MOLECULAR WEIGHT: 367.46464
SMILES: C1CN(CC=C1N2C3=CC=CC=C3NC2=O)CCCC(=O)C4=CC=CS4
Structure:
CAS RN: 102504-46-1
CAS Name: N-[1-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]-1-piperidinyl]propan-2-yl]-N-phenylpropanamide hydrochloride
OPENEYE Name: N-[2-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]-1-piperidyl]-1-methyl-ethyl]-N-phenyl-propanamide hydrochloride
IUPAC Name: N-[1-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]propan-2-yl]-N-phenylpropanamide hydrochloride
SYSTEMATIC NAME: N-[1-[4-oxidanyl-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]propan-2-yl]-N-phenyl-propanamide hydrochloride
MOLECULAR FORMULA: C24H30ClF3N2O2
MOLECULAR WEIGHT: 470.95541
SMILES: CCC(=O)N(C1=CC=CC=C1)C(C)CN2CCC(CC2)(C3=CC(=CC=C3)C(F)(F)F)O.Cl
Structure:
CAS RN: 102338-80-7
CAS Name: 2-hydroxy-2,2-diphenylacetic acid (2-methyl-1-azabicyclo[2.2.2]octan-3-yl) ester hydrochloride
OPENEYE Name: (2-methylquinuclidin-3-yl) 2-hydroxy-2,2-diphenyl-acetate hydrochloride
IUPAC Name: (2-methyl-1-azabicyclo[2.2.2]octan-3-yl) 2-hydroxy-2,2-diphenylacetate hydrochloride
SYSTEMATIC NAME: (2-methyl-1-azabicyclo[2.2.2]octan-3-yl) 2-oxidanyl-2,2-diphenyl-ethanoate hydrochloride
MOLECULAR FORMULA: C22H26ClNO3
MOLECULAR WEIGHT: 387.89974
SMILES: CC1C(C2CCN1CC2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O.Cl
Structure:
CAS RN: 15234-89-6
CAS Name: triphenyl-[[2-(triphenylphosphiniumylmethyl)phenyl]methyl]phosphonium
OPENEYE Name: triphenyl-[[2-(triphenylphosphaniumylmethyl)phenyl]methyl]phosphonium
IUPAC Name: triphenyl-[[2-(triphenylphosphaniumylmethyl)phenyl]methyl]phosphanium
SYSTEMATIC NAME: triphenyl-[[2-(triphenylphosphaniumylmethyl)phenyl]methyl]phosphanium
MOLECULAR FORMULA: C44H38P2+2
MOLECULAR WEIGHT: 628.720042
SMILES: C1=CC=C(C=C1)[P+](CC2=CC=CC=C2C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7
Structure:
CAS RN: 1519-46-6
CAS Name: triphenyl-[[2-(triphenylphosphiniumylmethyl)phenyl]methyl]phosphonium
OPENEYE Name: triphenyl-[[2-(triphenylphosphaniumylmethyl)phenyl]methyl]phosphonium
IUPAC Name: triphenyl-[[2-(triphenylphosphaniumylmethyl)phenyl]methyl]phosphanium
SYSTEMATIC NAME: triphenyl-[[2-(triphenylphosphaniumylmethyl)phenyl]methyl]phosphanium
MOLECULAR FORMULA: C44H38P2+2
MOLECULAR WEIGHT: 628.720042
SMILES: C1=CC=C(C=C1)[P+](CC2=CC=CC=C2C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7
Structure:
CAS RN: 1519-46-6
CAS Name: triphenyl-[[2-(triphenylphosphiniumylmethyl)phenyl]methyl]phosphonium bromide
OPENEYE Name: triphenyl-[[2-(triphenylphosphaniumylmethyl)phenyl]methyl]phosphonium bromide
IUPAC Name: triphenyl-[[2-(triphenylphosphaniumylmethyl)phenyl]methyl]phosphanium bromide
SYSTEMATIC NAME: triphenyl-[[2-(triphenylphosphaniumylmethyl)phenyl]methyl]phosphanium bromide
MOLECULAR FORMULA: C44H38BrP2+
MOLECULAR WEIGHT: 708.624042
SMILES: C1=CC=C(C=C1)[P+](CC2=CC=CC=C2C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7.[Br-]
Structure:
CAS RN: 191023-24-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H24O9
MOLECULAR WEIGHT: 456.44196
SMILES: CC1(OC2=C(C(C3=CC4=C(C=C3O1)OCO4)C5=CC(=C(C(=C5)OC)OC)OC)C(=O)OC2)C
Structure:
CAS RN: 102395-50-6
CAS Name: 8-[2-(1-benzothiophen-3-yl)ethyl]-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
OPENEYE Name: 8-[2-(benzothiophen-3-yl)ethyl]-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
IUPAC Name: 8-[2-(1-benzothiophen-3-yl)ethyl]-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
SYSTEMATIC NAME: 8-[2-(1-benzothiophen-3-yl)ethyl]-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
MOLECULAR FORMULA: C24H27N3OS
MOLECULAR WEIGHT: 405.55568
SMILES: CN1CN(C2(C1=O)CCN(CC2)CCC3=CSC4=CC=CC=C43)C5=CC=CC=C5
Structure:
CAS RN: 102395-45-9
CAS Name: 8-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
OPENEYE Name: 8-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
IUPAC Name: 8-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
SYSTEMATIC NAME: 8-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
MOLECULAR FORMULA: C24H29N3O3
MOLECULAR WEIGHT: 407.50536
SMILES: CN1CN(C2(C1=O)CCN(CC2)CCC3COC4=CC=CC=C4O3)C5=CC=CC=C5
Structure:
CAS RN: 102395-51-7
CAS Name: 8-(1-benzothiophen-3-ylmethyl)-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
OPENEYE Name: 8-(benzothiophen-3-ylmethyl)-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
IUPAC Name: 8-(1-benzothiophen-3-ylmethyl)-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
SYSTEMATIC NAME: 8-(1-benzothiophen-3-ylmethyl)-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
MOLECULAR FORMULA: C23H25N3OS
MOLECULAR WEIGHT: 391.5291
SMILES: CN1CN(C2(C1=O)CCN(CC2)CC3=CSC4=CC=CC=C43)C5=CC=CC=C5
Structure:
CAS RN: 92956-72-4
CAS Name: 2-cyclohexyl-2-hydroxy-3-pentynoic acid (1-methyl-4-piperidinyl) ester
OPENEYE Name: (1-methyl-4-piperidyl) 2-cyclohexyl-2-hydroxy-pent-3-ynoate
IUPAC Name: (1-methylpiperidin-4-yl) 2-cyclohexyl-2-hydroxypent-3-ynoate
SYSTEMATIC NAME: (1-methylpiperidin-4-yl) 2-cyclohexyl-2-oxidanyl-pent-3-ynoate
MOLECULAR FORMULA: C17H27NO3
MOLECULAR WEIGHT: 293.40118
SMILES: CC#CC(C1CCCCC1)(C(=O)OC2CCN(CC2)C)O
Structure:
CAS RN: 7248-87-5
CAS Name: 2,2,4-trimethyl-5-bicyclo[2.2.1]heptanol
OPENEYE Name: 1,5,5-trimethylnorbornan-2-ol
IUPAC Name: 2,2,4-trimethylbicyclo[2.2.1]heptan-5-ol
SYSTEMATIC NAME: 2,2,4-trimethylbicyclo[2.2.1]heptan-5-ol
MOLECULAR FORMULA: C10H18O
MOLECULAR WEIGHT: 154.24932
SMILES: CC1(CC2(CC1CC2O)C)C
Structure:
CAS RN: 102489-68-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C9H8F2S
MOLECULAR WEIGHT: 186.221626
SMILES: C1CC2CC1C3=C2SC(=C3F)F
Structure:
CAS RN: 102489-66-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C9H9F3S
MOLECULAR WEIGHT: 206.22797
SMILES: C1CC2CC1C3=C2SC(C3F)(F)F
Structure:
CAS RN: 13017-53-3
CAS Name: 1,1,5-trimethylfuro[3,4-c]pyridine-3,4-dione
OPENEYE Name: 1,1,5-trimethylfuro[3,4-c]pyridine-3,4-dione
IUPAC Name: 1,1,5-trimethylfuro[3,4-c]pyridine-3,4-dione
SYSTEMATIC NAME: 1,1,5-trimethylfuro[3,4-c]pyridine-3,4-dione
MOLECULAR FORMULA: C10H11NO3
MOLECULAR WEIGHT: 193.19924
SMILES: CC1(C2=C(C(=O)N(C=C2)C)C(=O)O1)C
Structure:
CAS RN: 102338-72-7
CAS Name: 2-(1-azabicyclo[2.2.2]octan-3-yl)propanedinitrile
OPENEYE Name: 2-quinuclidin-3-ylpropanedinitrile
IUPAC Name: 2-(1-azabicyclo[2.2.2]octan-3-yl)propanedinitrile
SYSTEMATIC NAME: 2-(1-azabicyclo[2.2.2]octan-3-yl)propanedinitrile
MOLECULAR FORMULA: C10H13N3
MOLECULAR WEIGHT: 175.23032
SMILES: C1CN2CCC1C(C2)C(C#N)C#N
Structure:
CAS RN: 102280-69-3
CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)carbamic acid ethyl ester
OPENEYE Name: ethyl N-quinuclidin-3-ylcarbamate
IUPAC Name: ethyl N-(1-azabicyclo[2.2.2]octan-3-yl)carbamate
SYSTEMATIC NAME: ethyl N-(1-azabicyclo[2.2.2]octan-3-yl)carbamate
MOLECULAR FORMULA: C10H18N2O2
MOLECULAR WEIGHT: 198.26212
SMILES: CCOC(=O)NC1CN2CCC1CC2
Structure:
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