CAS RN: 17239-04-2
CAS Name: acetic acid (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) ester
OPENEYE Name: (1-methylquinuclidin-1-ium-3-yl) acetate
IUPAC Name: (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) acetate
SYSTEMATIC NAME: (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) ethanoate
MOLECULAR FORMULA: C10H18NO2+
MOLECULAR WEIGHT: 184.25542
SMILES: CC(=O)OC1C[N+]2(CCC1CC2)C
Structure:
CAS RN: 6659-53-6
CAS Name: acetic acid (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) ester iodide
OPENEYE Name: (1-methylquinuclidin-1-ium-3-yl) acetate iodide
IUPAC Name: (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) acetate iodide
SYSTEMATIC NAME: (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) ethanoate iodide
MOLECULAR FORMULA: C10H18INO2
MOLECULAR WEIGHT: 311.15989
SMILES: CC(=O)OC1C[N+]2(CCC1CC2)C.[I-]
Structure:
CAS RN: 6659-51-4
CAS Name: 1-methyl-1-azoniabicyclo[2.2.2]octan-3-one iodide
OPENEYE Name: 1-methylquinuclidin-1-ium-3-one iodide
IUPAC Name: 1-methyl-1-azoniabicyclo[2.2.2]octan-3-one iodide
SYSTEMATIC NAME: 1-methyl-1-azoniabicyclo[2.2.2]octan-3-one iodide
MOLECULAR FORMULA: C8H14INO
MOLECULAR WEIGHT: 267.10733
SMILES: C[N+]12CCC(CC1)C(=O)C2.[I-]
Structure:
CAS RN: 6658-61-3
CAS Name: 2-(4-chlorophenoxy)acetic 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-(4-chlorophenoxy)acetate
IUPAC Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(4-chlorophenoxy)acetate
SYSTEMATIC NAME: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(4-chloranylphenoxy)ethanoate
MOLECULAR FORMULA: C16H20ClNO3
MOLECULAR WEIGHT: 309.7879
SMILES: CN1C2CCC1CC(C2)OC(=O)COC3=CC=C(C=C3)Cl
Structure:
CAS RN: 6640-23-9
CAS Name: pyrimidine-4,5,6-triamine; sulfuric acid; hydrate
OPENEYE Name: pyrimidine-4,5,6-triamine; sulfuric acid; hydrate
IUPAC Name: pyrimidine-4,5,6-triamine; sulfuric acid; hydrate
SYSTEMATIC NAME: pyrimidine-4,5,6-triamine; sulfuric acid; hydrate
MOLECULAR FORMULA: C4H11N5O5S
MOLECULAR WEIGHT: 241.22564
SMILES: C1=NC(=C(C(=N1)N)N)N.O.OS(=O)(=O)O
Structure:
CAS RN: 6620-54-8
CAS Name: 4-benzamido-5-(4-ethoxycarbonylanilino)-5-oxopentanoic acid
OPENEYE Name: 4-benzamido-5-(4-ethoxycarbonylanilino)-5-oxo-pentanoic acid
IUPAC Name: 4-benzamido-5-(4-ethoxycarbonylanilino)-5-oxopentanoic acid
SYSTEMATIC NAME: 4-benzamido-5-[(4-ethoxycarbonylphenyl)amino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C21H22N2O6
MOLECULAR WEIGHT: 398.40918
SMILES: CCOC(=O)C1=CC=C(C=C1)NC(=O)C(CCC(=O)O)NC(=O)C2=CC=CC=C2
Structure:
CAS RN: 6616-82-6
CAS Name: 1-acetyl-3-(5-nitro-2-thiazolyl)-2-imidazolidinone
OPENEYE Name: 1-acetyl-3-(5-nitrothiazol-2-yl)imidazolidin-2-one
IUPAC Name: 1-acetyl-3-(5-nitro-1,3-thiazol-2-yl)imidazolidin-2-one
SYSTEMATIC NAME: 1-ethanoyl-3-(5-nitro-1,3-thiazol-2-yl)imidazolidin-2-one
MOLECULAR FORMULA: C8H8N4O4S
MOLECULAR WEIGHT: 256.23852
SMILES: CC(=O)N1CCN(C1=O)C2=NC=C(S2)[N+](=O)[O-]
Structure:
CAS RN: 6613-19-0
CAS Name: 2-[3-(3-hydroxyphenyl)-3-methyl-1-piperidinyl]-1-phenylethanone hydrochloride
OPENEYE Name: 2-[3-(3-hydroxyphenyl)-3-methyl-1-piperidyl]-1-phenyl-ethanone hydrochloride
IUPAC Name: 2-[3-(3-hydroxyphenyl)-3-methylpiperidin-1-yl]-1-phenylethanone hydrochloride
SYSTEMATIC NAME: 2-[3-(3-hydroxyphenyl)-3-methyl-piperidin-1-yl]-1-phenyl-ethanone hydrochloride
MOLECULAR FORMULA: C20H24ClNO2
MOLECULAR WEIGHT: 345.86306
SMILES: CC1(CCCN(C1)CC(=O)C2=CC=CC=C2)C3=CC(=CC=C3)O.Cl
Structure:
CAS RN: 6606-13-9
CAS Name: 2-hydroxy-2,2-diphenylacetic acid [9-[(2-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] ester
OPENEYE Name: [9-(o-tolylmethyl)-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenyl-acetate
IUPAC Name: [9-[(2-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-hydroxy-2,2-diphenylacetate
SYSTEMATIC NAME: [9-[(2-methylphenyl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-oxidanyl-2,2-diphenyl-ethanoate
MOLECULAR FORMULA: C30H33NO3
MOLECULAR WEIGHT: 455.58792
SMILES: CC1=CC=CC=C1CN2C3CCCC2CC(C3)OC(=O)C(C4=CC=CC=C4)(C5=CC=CC=C5)O
Structure:
CAS RN: 6606-10-6
CAS Name: 2-cyclohexyl-2-hydroxy-2-phenylacetic acid (9-methyl-9-azabicyclo[3.3.1]nonan-3-yl) ester
OPENEYE Name: (9-methyl-9-azabicyclo[3.3.1]nonan-3-yl) 2-cyclohexyl-2-hydroxy-2-phenyl-acetate
IUPAC Name: (9-methyl-9-azabicyclo[3.3.1]nonan-3-yl) 2-cyclohexyl-2-hydroxy-2-phenylacetate
SYSTEMATIC NAME: (9-methyl-9-azabicyclo[3.3.1]nonan-3-yl) 2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoate
MOLECULAR FORMULA: C23H33NO3
MOLECULAR WEIGHT: 371.51302
SMILES: CN1C2CCCC1CC(C2)OC(=O)C(C3CCCCC3)(C4=CC=CC=C4)O
Structure:
CAS RN: 6604-67-7
CAS Name: 3-[4-methyl-1-(2-phenylethyl)-3-propyl-3-piperidinyl]phenol; oxalic acid
OPENEYE Name: 3-[4-methyl-1-(2-phenylethyl)-3-propyl-3-piperidyl]phenol; oxalic acid
IUPAC Name: 3-[4-methyl-1-(2-phenylethyl)-3-propylpiperidin-3-yl]phenol; oxalic acid
SYSTEMATIC NAME: ethanedioic acid; 3-[4-methyl-1-(2-phenylethyl)-3-propyl-piperidin-3-yl]phenol
MOLECULAR FORMULA: C25H33NO5
MOLECULAR WEIGHT: 427.53322
SMILES: CCCC1(CN(CCC1C)CCC2=CC=CC=C2)C3=CC(=CC=C3)O.C(=O)(C(=O)O)O
Structure:
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