CAS RN: 40004-08-8
CAS Name: 2-(1-piperazinyl)acetic acid ethyl ester
OPENEYE Name: ethyl 2-piperazin-1-ylacetate
IUPAC Name: ethyl 2-piperazin-1-ylacetate
SYSTEMATIC NAME: ethyl 2-piperazin-1-ylethanoate
MOLECULAR FORMULA: C8H16N2O2
MOLECULAR WEIGHT: 172.22484
SMILES: CCOC(=O)CN1CCNCC1
Structure:
CAS RN: 29140-80-5
CAS Name: 4-(2-ethoxy-2-oxoethyl)-1-piperazinecarbodithioic acid; 2-(1-piperazinyl)acetic acid ethyl ester
OPENEYE Name: 4-(2-ethoxy-2-oxo-ethyl)piperazine-1-carbodithioic acid; ethyl 2-piperazin-1-ylacetate
IUPAC Name: 4-(2-ethoxy-2-oxoethyl)piperazine-1-carbodithioic acid; ethyl 2-piperazin-1-ylacetate
SYSTEMATIC NAME: 4-(2-ethoxy-2-oxidanylidene-ethyl)piperazine-1-carbodithioic acid; ethyl 2-piperazin-1-ylethanoate
MOLECULAR FORMULA: C17H32N4O4S2
MOLECULAR WEIGHT: 420.59038
SMILES: CCOC(=O)CN1CCNCC1.CCOC(=O)CN1CCN(CC1)C(=S)S
Structure:
CAS RN: 29140-79-2
CAS Name: 10-phenothiazinecarbothioic acid S-[(4-methyl-1-piperazinyl)-sulfanylidenemethyl] ester
OPENEYE Name: S-(4-methylpiperazine-1-carbothioyl) phenothiazine-10-carbothioate
IUPAC Name: S-(4-methylpiperazine-1-carbothioyl) phenothiazine-10-carbothioate
SYSTEMATIC NAME: S-(4-methylpiperazin-1-yl)carbothioyl phenothiazine-10-carbothioate
MOLECULAR FORMULA: C19H19N3OS3
MOLECULAR WEIGHT: 401.56866
SMILES: CN1CCN(CC1)C(=S)SC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42
Structure:
CAS RN: 29140-76-9
CAS Name: 4-methyl-1-piperazinecarbodithioic acid ethyl ester hydrochloride
OPENEYE Name: ethyl 4-methylpiperazine-1-carbodithioate hydrochloride
IUPAC Name: ethyl 4-methylpiperazine-1-carbodithioate hydrochloride
SYSTEMATIC NAME: ethyl 4-methylpiperazine-1-carbodithioate hydrochloride
MOLECULAR FORMULA: C8H17ClN2S2
MOLECULAR WEIGHT: 240.81698
SMILES: CCSC(=S)N1CCN(CC1)C.Cl
Structure:
CAS RN: 29140-72-5
CAS Name: 3-methyl-4-pentyl-1-piperazinecarbodithioic acid
OPENEYE Name: 3-methyl-4-pentyl-piperazine-1-carbodithioic acid
IUPAC Name: 3-methyl-4-pentylpiperazine-1-carbodithioic acid
SYSTEMATIC NAME: 3-methyl-4-pentyl-piperazine-1-carbodithioic acid
MOLECULAR FORMULA: C11H22N2S2
MOLECULAR WEIGHT: 246.43578
SMILES: CCCCCN1CCN(CC1C)C(=S)S
Structure:
CAS RN: 29140-64-5
CAS Name: 4,4-dimethyl-1-piperazin-4-iumcarbodithioate
OPENEYE Name: 4,4-dimethylpiperazin-4-ium-1-carbodithioate
IUPAC Name: 4,4-dimethylpiperazin-4-ium-1-carbodithioate
SYSTEMATIC NAME: 4,4-dimethylpiperazin-4-ium-1-carbodithioate
MOLECULAR FORMULA: C7H14N2S2
MOLECULAR WEIGHT: 190.32946
SMILES: C[N+]1(CCN(CC1)C(=S)[S-])C
Structure:
CAS RN: 29140-59-8
CAS Name: 4-(2-hydroxyethyl)-1-piperazinecarbodithioic acid
OPENEYE Name: 4-(2-hydroxyethyl)piperazine-1-carbodithioic acid
IUPAC Name: 4-(2-hydroxyethyl)piperazine-1-carbodithioic acid
SYSTEMATIC NAME: 4-(2-hydroxyethyl)piperazine-1-carbodithioic acid
MOLECULAR FORMULA: C7H14N2OS2
MOLECULAR WEIGHT: 206.32886
SMILES: C1CN(CCN1CCO)C(=S)S
Structure:
CAS RN: 29140-57-6
CAS Name: 4-ethyl-1-piperazinecarbodithioic acid
OPENEYE Name: 4-ethylpiperazine-1-carbodithioic acid
IUPAC Name: 4-ethylpiperazine-1-carbodithioic acid
SYSTEMATIC NAME: 4-ethylpiperazine-1-carbodithioic acid
MOLECULAR FORMULA: C7H14N2S2
MOLECULAR WEIGHT: 190.32946
SMILES: CCN1CCN(CC1)C(=S)S
Structure:
CAS RN: 29138-42-9
CAS Name: N,N-dimethyl-3-[1-phenyl-3,3-bis(trifluoromethyl)-1-isobenzofuranyl]-1-propanamine hydrochloride
OPENEYE Name: N,N-dimethyl-3-[1-phenyl-3,3-bis(trifluoromethyl)isobenzofuran-1-yl]propan-1-amine hydrochloride
IUPAC Name: N,N-dimethyl-3-[1-phenyl-3,3-bis(trifluoromethyl)-2-benzofuran-1-yl]propan-1-amine hydrochloride
SYSTEMATIC NAME: N,N-dimethyl-3-[1-phenyl-3,3-bis(trifluoromethyl)-2-benzofuran-1-yl]propan-1-amine hydrochloride
MOLECULAR FORMULA: C21H22ClF6NO
MOLECULAR WEIGHT: 453.848899
SMILES: CN(C)CCCC1(C2=CC=CC=C2C(O1)(C(F)(F)F)C(F)(F)F)C3=CC=CC=C3.Cl
Structure:
CAS RN: 29138-41-8
CAS Name: 3-(3,3-dimethyl-1-phenyl-1-isobenzofuranyl)-1-propanamine; oxalic acid
OPENEYE Name: 3-(3,3-dimethyl-1-phenyl-isobenzofuran-1-yl)propan-1-amine; oxalic acid
IUPAC Name: 3-(3,3-dimethyl-1-phenyl-2-benzofuran-1-yl)propan-1-amine; oxalic acid
SYSTEMATIC NAME: 3-(3,3-dimethyl-1-phenyl-2-benzofuran-1-yl)propan-1-amine; ethanedioic acid
MOLECULAR FORMULA: C21H25NO5
MOLECULAR WEIGHT: 371.4269
SMILES: CC1(C2=CC=CC=C2C(O1)(CCCN)C3=CC=CC=C3)C.C(=O)(C(=O)O)O
Structure:
CAS RN: 29135-16-8
CAS Name: 2-propylpentanoic acid [2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-2-oxo-1-phenylethyl] ester
OPENEYE Name: [2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-2-oxo-1-phenyl-ethyl] 2-propylpentanoate
IUPAC Name: [2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-2-oxo-1-phenylethyl] 2-propylpentanoate
SYSTEMATIC NAME: [2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-2-oxidanylidene-1-phenyl-ethyl] 2-propylpentanoate
MOLECULAR FORMULA: C24H35NO4
MOLECULAR WEIGHT: 401.539
SMILES: CCCC(CCC)C(=O)OC(C1=CC=CC=C1)C(=O)OC2CC3CCC(C2)N3C
Structure:
CAS RN: 29125-67-5
CAS Name: 9H-xanthene-9-carboxylic acid (1-butyl-1-azoniabicyclo[2.2.2]octan-3-yl) ester bromide
OPENEYE Name: (1-butylquinuclidin-1-ium-3-yl) 9H-xanthene-9-carboxylate bromide
IUPAC Name: (1-butyl-1-azoniabicyclo[2.2.2]octan-3-yl) 9H-xanthene-9-carboxylate bromide
SYSTEMATIC NAME: (1-butyl-1-azoniabicyclo[2.2.2]octan-3-yl) 9H-xanthene-9-carboxylate bromide
MOLECULAR FORMULA: C25H30BrNO3
MOLECULAR WEIGHT: 472.4146
SMILES: CCCC[N+]12CCC(CC1)C(C2)OC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35.[Br-]
Structure:
CAS RN: 29125-66-4
CAS Name: 9,10-dihydroanthracene-9-carboxylic acid (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) ester bromide
OPENEYE Name: (1-methylquinuclidin-1-ium-3-yl) 9,10-dihydroanthracene-9-carboxylate bromide
IUPAC Name: (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 9,10-dihydroanthracene-9-carboxylate bromide
SYSTEMATIC NAME: (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 9,10-dihydroanthracene-9-carboxylate bromide
MOLECULAR FORMULA: C23H26BrNO2
MOLECULAR WEIGHT: 428.36204
SMILES: C[N+]12CCC(CC1)C(C2)OC(=O)C3C4=CC=CC=C4CC5=CC=CC=C35.[Br-]
Structure:
CAS RN: 29125-65-3
CAS Name: 9,10-dihydroanthracene-9-carboxylic acid 1-azabicyclo[2.2.2]octan-3-yl ester
OPENEYE Name: quinuclidin-3-yl 9,10-dihydroanthracene-9-carboxylate
IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl 9,10-dihydroanthracene-9-carboxylate
SYSTEMATIC NAME: 1-azabicyclo[2.2.2]octan-3-yl 9,10-dihydroanthracene-9-carboxylate
MOLECULAR FORMULA: C22H23NO2
MOLECULAR WEIGHT: 333.42352
SMILES: C1CN2CCC1C(C2)OC(=O)C3C4=CC=CC=C4CC5=CC=CC=C35
Structure:
CAS RN: 29125-64-2
CAS Name: 9H-xanthene-9-carboxylic acid (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) ester bromide
OPENEYE Name: (1-methylquinuclidin-1-ium-3-yl) 9H-xanthene-9-carboxylate bromide
IUPAC Name: (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 9H-xanthene-9-carboxylate bromide
SYSTEMATIC NAME: (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 9H-xanthene-9-carboxylate bromide
MOLECULAR FORMULA: C22H24BrNO3
MOLECULAR WEIGHT: 430.33486
SMILES: C[N+]12CCC(CC1)C(C2)OC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35.[Br-]
Structure:
CAS RN: 29125-63-1
CAS Name: 9H-xanthene-9-carboxylic acid 1-azabicyclo[2.2.2]octan-3-yl ester hydrochloride
OPENEYE Name: quinuclidin-3-yl 9H-xanthene-9-carboxylate hydrochloride
IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl 9H-xanthene-9-carboxylate hydrochloride
SYSTEMATIC NAME: 1-azabicyclo[2.2.2]octan-3-yl 9H-xanthene-9-carboxylate hydrochloride
MOLECULAR FORMULA: C21H22ClNO3
MOLECULAR WEIGHT: 371.85728
SMILES: C1CN2CCC1C(C2)OC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35.Cl
Structure:
CAS RN: 29125-57-3
CAS Name: 2-cyclopentyl-2-hydroxy-2-phenylacetic acid (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) ester bromide
OPENEYE Name: (1-methylquinuclidin-1-ium-3-yl) 2-cyclopentyl-2-hydroxy-2-phenyl-acetate bromide
IUPAC Name: (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate bromide
SYSTEMATIC NAME: (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate bromide
MOLECULAR FORMULA: C21H30BrNO3
MOLECULAR WEIGHT: 424.3718
SMILES: C[N+]12CCC(CC1)C(C2)OC(=O)C(C3CCCC3)(C4=CC=CC=C4)O.[Br-]
Structure:
CAS RN: 29125-55-1
CAS Name: 2-cyclopentyl-2-hydroxy-2-phenylacetic acid 1-azabicyclo[2.2.2]octan-3-yl ester hydrochloride
OPENEYE Name: quinuclidin-3-yl 2-cyclopentyl-2-hydroxy-2-phenyl-acetate hydrochloride
IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl 2-cyclopentyl-2-hydroxy-2-phenylacetate hydrochloride
SYSTEMATIC NAME: 1-azabicyclo[2.2.2]octan-3-yl 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate hydrochloride
MOLECULAR FORMULA: C20H28ClNO3
MOLECULAR WEIGHT: 365.89422
SMILES: C1CCC(C1)C(C2=CC=CC=C2)(C(=O)OC3CN4CCC3CC4)O.Cl
Structure:
CAS RN: 29125-54-0
CAS Name: 2-cyclohexyl-2-hydroxy-2-phenylacetic acid 1-azabicyclo[2.2.2]octan-3-yl ester
OPENEYE Name: quinuclidin-3-yl 2-cyclohexyl-2-hydroxy-2-phenyl-acetate
IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl 2-cyclohexyl-2-hydroxy-2-phenylacetate
SYSTEMATIC NAME: 1-azabicyclo[2.2.2]octan-3-yl 2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoate
MOLECULAR FORMULA: C21H29NO3
MOLECULAR WEIGHT: 343.45986
SMILES: C1CCC(CC1)C(C2=CC=CC=C2)(C(=O)OC3CN4CCC3CC4)O
Structure:
CAS RN: 29122-66-5
CAS Name: 4-[2-(5-chloro-2-ethoxyphenyl)-3-methylpentyl]morpholine
OPENEYE Name: 4-[2-(5-chloro-2-ethoxy-phenyl)-3-methyl-pentyl]morpholine
IUPAC Name: 4-[2-(5-chloro-2-ethoxyphenyl)-3-methylpentyl]morpholine
SYSTEMATIC NAME: 4-[2-(5-chloranyl-2-ethoxy-phenyl)-3-methyl-pentyl]morpholine
MOLECULAR FORMULA: C18H28ClNO2
MOLECULAR WEIGHT: 325.87342
SMILES: CCC(C)C(CN1CCOCC1)C2=C(C=CC(=C2)Cl)OCC
Structure:
CAS RN: 29122-64-3
CAS Name: 1-[2-(5-chloro-2-ethoxyphenyl)-3-methylpentyl]-4-methylpiperazine
OPENEYE Name: 1-[2-(5-chloro-2-ethoxy-phenyl)-3-methyl-pentyl]-4-methyl-piperazine
IUPAC Name: 1-[2-(5-chloro-2-ethoxyphenyl)-3-methylpentyl]-4-methylpiperazine
SYSTEMATIC NAME: 1-[2-(5-chloranyl-2-ethoxy-phenyl)-3-methyl-pentyl]-4-methyl-piperazine
MOLECULAR FORMULA: C19H31ClN2O
MOLECULAR WEIGHT: 338.91524
SMILES: CCC(C)C(CN1CCN(CC1)C)C2=C(C=CC(=C2)Cl)OCC
Structure:
CAS RN: 29122-60-9
CAS Name: 1-[2-(5-chloro-2-ethoxyphenyl)-3-methylpentyl]piperidine
OPENEYE Name: 1-[2-(5-chloro-2-ethoxy-phenyl)-3-methyl-pentyl]piperidine
IUPAC Name: 1-[2-(5-chloro-2-ethoxyphenyl)-3-methylpentyl]piperidine
SYSTEMATIC NAME: 1-[2-(5-chloranyl-2-ethoxy-phenyl)-3-methyl-pentyl]piperidine
MOLECULAR FORMULA: C19H30ClNO
MOLECULAR WEIGHT: 323.9006
SMILES: CCC(C)C(CN1CCCCC1)C2=C(C=CC(=C2)Cl)OCC
Structure:
CAS RN: 29122-58-5
CAS Name: 1-[2-(5-chloro-2-ethoxyphenyl)-3-methylpentyl]pyrrolidine
OPENEYE Name: 1-[2-(5-chloro-2-ethoxy-phenyl)-3-methyl-pentyl]pyrrolidine
IUPAC Name: 1-[2-(5-chloro-2-ethoxyphenyl)-3-methylpentyl]pyrrolidine
SYSTEMATIC NAME: 1-[2-(5-chloranyl-2-ethoxy-phenyl)-3-methyl-pentyl]pyrrolidine
MOLECULAR FORMULA: C18H28ClNO
MOLECULAR WEIGHT: 309.87402
SMILES: CCC(C)C(CN1CCCC1)C2=C(C=CC(=C2)Cl)OCC
Structure:
CAS RN: 29122-56-3
CAS Name: 2-(5-chloro-2-ethoxyphenyl)-3-methyl-N,N-di(propan-2-yl)-1-pentanamine
OPENEYE Name: 2-(5-chloro-2-ethoxy-phenyl)-N,N-diisopropyl-3-methyl-pentan-1-amine
IUPAC Name: 2-(5-chloro-2-ethoxyphenyl)-3-methyl-N,N-di(propan-2-yl)pentan-1-amine
SYSTEMATIC NAME: 2-(5-chloranyl-2-ethoxy-phenyl)-3-methyl-N,N-di(propan-2-yl)pentan-1-amine
MOLECULAR FORMULA: C20H34ClNO
MOLECULAR WEIGHT: 339.94306
SMILES: CCC(C)C(CN(C(C)C)C(C)C)C1=C(C=CC(=C1)Cl)OCC
Structure:
CAS RN: 29122-51-8
CAS Name: 2-(5-chloro-2-ethoxyphenyl)-3-methyl-1-pentanamine
OPENEYE Name: 2-(5-chloro-2-ethoxy-phenyl)-3-methyl-pentan-1-amine
IUPAC Name: 2-(5-chloro-2-ethoxyphenyl)-3-methylpentan-1-amine
SYSTEMATIC NAME: 2-(5-chloranyl-2-ethoxy-phenyl)-3-methyl-pentan-1-amine
MOLECULAR FORMULA: C14H22ClNO
MOLECULAR WEIGHT: 255.78358
SMILES: CCC(C)C(CN)C1=C(C=CC(=C1)Cl)OCC
Structure:
CAS RN: 29122-07-4
CAS Name: 1-ethyl-8-(1,2,3,4-tetrahydronaphthalen-2-yl)-4-oxa-2,8-diazaspiro[4.5]decan-3-one
OPENEYE Name: 1-ethyl-8-tetralin-2-yl-4-oxa-2,8-diazaspiro[4.5]decan-3-one
IUPAC Name: 1-ethyl-8-(1,2,3,4-tetrahydronaphthalen-2-yl)-4-oxa-2,8-diazaspiro[4.5]decan-3-one
SYSTEMATIC NAME: 1-ethyl-8-(1,2,3,4-tetrahydronaphthalen-2-yl)-4-oxa-2,8-diazaspiro[4.5]decan-3-one
MOLECULAR FORMULA: C19H26N2O2
MOLECULAR WEIGHT: 314.42194
SMILES: CCC1C2(CCN(CC2)C3CCC4=CC=CC=C4C3)OC(=O)N1
Structure:
CAS RN: 29114-89-4
CAS Name: N1,N3-bis(2-bromophenyl)-4-hydroxybenzene-1,3-dicarboxamide
OPENEYE Name: N1,N3-bis(2-bromophenyl)-4-hydroxy-benzene-1,3-dicarboxamide
IUPAC Name: 1-N,3-N-bis(2-bromophenyl)-4-hydroxybenzene-1,3-dicarboxamide
SYSTEMATIC NAME: N1,N3-bis(2-bromophenyl)-4-oxidanyl-benzene-1,3-dicarboxamide
MOLECULAR FORMULA: C20H14Br2N2O3
MOLECULAR WEIGHT: 490.14476
SMILES: C1=CC=C(C(=C1)NC(=O)C2=CC(=C(C=C2)O)C(=O)NC3=CC=CC=C3Br)Br
Structure:
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