CAS RN: 4266-80-2
CAS Name: 4-ethyl-1-propyl-3,5,8-trioxabicyclo[2.2.2]octane
OPENEYE Name: 4-ethyl-1-propyl-3,5,8-trioxabicyclo[2.2.2]octane
IUPAC Name: 4-ethyl-1-propyl-3,5,8-trioxabicyclo[2.2.2]octane
SYSTEMATIC NAME: 4-ethyl-1-propyl-3,5,8-trioxabicyclo[2.2.2]octane
MOLECULAR FORMULA: C10H18O3
MOLECULAR WEIGHT: 186.24812
SMILES: CCCC12COC(OC1)(OC2)CC
Structure:
CAS RN: 4252-88-4
CAS Name: [phenyl(propyl)phosphoryl]benzene
OPENEYE Name: [phenyl(propyl)phosphoryl]benzene
IUPAC Name: [phenyl(propyl)phosphoryl]benzene
SYSTEMATIC NAME: [phenyl(propyl)phosphoryl]benzene
MOLECULAR FORMULA: C15H17OP
MOLECULAR WEIGHT: 244.268641
SMILES: CCCP(=O)(C1=CC=CC=C1)C2=CC=CC=C2
Structure:
CAS RN: 4252-09-9
CAS Name: 2,4-diphenylcyclobutane-1,3-dicarboxylic acid bis[3-(1-methyl-1-piperidin-1-iumyl)propyl] ester diiodide
OPENEYE Name: bis[3-(1-methylpiperidin-1-ium-1-yl)propyl] 2,4-diphenylcyclobutane-1,3-dicarboxylate diiodide
IUPAC Name: bis[3-(1-methylpiperidin-1-ium-1-yl)propyl] 2,4-diphenylcyclobutane-1,3-dicarboxylate diiodide
SYSTEMATIC NAME: bis[3-(1-methylpiperidin-1-ium-1-yl)propyl] 2,4-diphenylcyclobutane-1,3-dicarboxylate diiodide
MOLECULAR FORMULA: C36H52I2N2O4
MOLECULAR WEIGHT: 830.61802
SMILES: C[N+]1(CCCCC1)CCCOC(=O)C2C(C(C2C3=CC=CC=C3)C(=O)OCCC[N+]4(CCCCC4)C)C5=CC=CC=C5.[I-].[I-]
Structure:
CAS RN: 4252-08-8
CAS Name: 2,4-diphenylcyclobutane-1,3-dicarboxylic acid bis[3-(1-ethyl-1-pyrrolidin-1-iumyl)propyl] ester diiodide
OPENEYE Name: bis[3-(1-ethylpyrrolidin-1-ium-1-yl)propyl] 2,4-diphenylcyclobutane-1,3-dicarboxylate diiodide
IUPAC Name: bis[3-(1-ethylpyrrolidin-1-ium-1-yl)propyl] 2,4-diphenylcyclobutane-1,3-dicarboxylate diiodide
SYSTEMATIC NAME: bis[3-(1-ethylpyrrolidin-1-ium-1-yl)propyl] 2,4-diphenylcyclobutane-1,3-dicarboxylate diiodide
MOLECULAR FORMULA: C36H52I2N2O4
MOLECULAR WEIGHT: 830.61802
SMILES: CC[N+]1(CCCC1)CCCOC(=O)C2C(C(C2C3=CC=CC=C3)C(=O)OCCC[N+]4(CCCC4)CC)C5=CC=CC=C5.[I-].[I-]
Structure:
CAS RN: 4252-07-7
CAS Name: 2,4-diphenylcyclobutane-1,3-dicarboxylic acid bis[3-(1-methyl-1-pyrrolidin-1-iumyl)propyl] ester diiodide
OPENEYE Name: bis[3-(1-methylpyrrolidin-1-ium-1-yl)propyl] 2,4-diphenylcyclobutane-1,3-dicarboxylate diiodide
IUPAC Name: bis[3-(1-methylpyrrolidin-1-ium-1-yl)propyl] 2,4-diphenylcyclobutane-1,3-dicarboxylate diiodide
SYSTEMATIC NAME: bis[3-(1-methylpyrrolidin-1-ium-1-yl)propyl] 2,4-diphenylcyclobutane-1,3-dicarboxylate diiodide
MOLECULAR FORMULA: C34H48I2N2O4
MOLECULAR WEIGHT: 802.56486
SMILES: C[N+]1(CCCC1)CCCOC(=O)C2C(C(C2C3=CC=CC=C3)C(=O)OCCC[N+]4(CCCC4)C)C5=CC=CC=C5.[I-].[I-]
Structure:
CAS RN: 4248-04-8
CAS Name: (8S,9S,13R,14S)-3-methoxy-6,7,8,9,11,12,13,14,15,16-decahydrocyclopenta[a]phenanthren-17-one
OPENEYE Name: (8S,9S,13R,14S)-3-methoxy-6,7,8,9,11,12,13,14,15,16-decahydrocyclopenta[a]phenanthren-17-one
IUPAC Name: (8S,9S,13R,14S)-3-methoxy-6,7,8,9,11,12,13,14,15,16-decahydrocyclopenta[a]phenanthren-17-one
SYSTEMATIC NAME: (8S,9S,13R,14S)-3-methoxy-6,7,8,9,11,12,13,14,15,16-decahydrocyclopenta[a]phenanthren-17-one
MOLECULAR FORMULA: C18H22O2
MOLECULAR WEIGHT: 270.36608
SMILES: COC1=CC2=C(C=C1)[C@H]3CC[C@@H]4[C@H]([C@@H]3CC2)CCC4=O
Structure:
CAS RN: 18031-11-3
CAS Name: 3-(4-acetyloxyphenyl)-2-phenylpropanoic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester hydrochloride
OPENEYE Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-(4-acetoxyphenyl)-2-phenyl-propanoate hydrochloride
IUPAC Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-(4-acetyloxyphenyl)-2-phenylpropanoate hydrochloride
SYSTEMATIC NAME: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-(4-acetyloxyphenyl)-2-phenyl-propanoate hydrochloride
MOLECULAR FORMULA: C25H30ClNO4
MOLECULAR WEIGHT: 443.963
SMILES: CC(=O)OC1=CC=C(C=C1)CC(C2=CC=CC=C2)C(=O)OC3CC4CCC(C3)N4C.Cl
Structure:
CAS RN: 4241-47-8
CAS Name: 3-(4-acetyloxyphenyl)-2-phenylpropanoic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester hydrochloride
OPENEYE Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-(4-acetoxyphenyl)-2-phenyl-propanoate hydrochloride
IUPAC Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-(4-acetyloxyphenyl)-2-phenylpropanoate hydrochloride
SYSTEMATIC NAME: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-(4-acetyloxyphenyl)-2-phenyl-propanoate hydrochloride
MOLECULAR FORMULA: C25H30ClNO4
MOLECULAR WEIGHT: 443.963
SMILES: CC(=O)OC1=CC=C(C=C1)CC(C2=CC=CC=C2)C(=O)OC3CC4CCC(C3)N4C.Cl
Structure:
CAS RN: 4238-84-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H21N3O
MOLECULAR WEIGHT: 295.37884
SMILES: CN1C[C@@H](C=C2[C@H]1CC3=CNC4=CC=CC2=C34)C(=O)N(C)C
Structure:
CAS RN: 4238-76-0
CAS Name: 3-(2-aminophenyl)-3-ethylpiperidine-2,6-dione
OPENEYE Name: 3-(2-aminophenyl)-3-ethyl-piperidine-2,6-dione
IUPAC Name: 3-(2-aminophenyl)-3-ethylpiperidine-2,6-dione
SYSTEMATIC NAME: 3-(2-aminophenyl)-3-ethyl-piperidine-2,6-dione
MOLECULAR FORMULA: C13H16N2O2
MOLECULAR WEIGHT: 232.27834
SMILES: CCC1(CCC(=O)NC1=O)C2=CC=CC=C2N
Structure:
CAS RN: 4238-09-9
CAS Name: propan-2-ylsulfonylbenzene
OPENEYE Name: isopropylsulfonylbenzene
IUPAC Name: propan-2-ylsulfonylbenzene
SYSTEMATIC NAME: propan-2-ylsulfonylbenzene
MOLECULAR FORMULA: C9H12O2S
MOLECULAR WEIGHT: 184.25538
SMILES: CC(C)S(=O)(=O)C1=CC=CC=C1
Structure:
CAS RN: 4236-45-7
CAS Name: 1-(4-fluorophenyl)-4-[methyl(2-phenylethyl)amino]-1-phenyl-1-butanol; oxalic acid
OPENEYE Name: 1-(4-fluorophenyl)-4-[methyl(2-phenylethyl)amino]-1-phenyl-butan-1-ol; oxalic acid
IUPAC Name: 1-(4-fluorophenyl)-4-[methyl(2-phenylethyl)amino]-1-phenylbutan-1-ol; oxalic acid
SYSTEMATIC NAME: ethanedioic acid; 1-(4-fluorophenyl)-4-[methyl(2-phenylethyl)amino]-1-phenyl-butan-1-ol
MOLECULAR FORMULA: C27H30FNO5
MOLECULAR WEIGHT: 467.529203
SMILES: CN(CCCC(C1=CC=CC=C1)(C2=CC=C(C=C2)F)O)CCC3=CC=CC=C3.C(=O)(C(=O)O)O
Structure:
CAS RN: 4234-34-8
CAS Name: 4-[[2-[[4-(dimethylsulfamoyl)phenyl]methylamino]ethylamino]methyl]-N,N-dimethylbenzenesulfonamide
OPENEYE Name: 4-[[2-[[4-(dimethylsulfamoyl)phenyl]methylamino]ethylamino]methyl]-N,N-dimethyl-benzenesulfonamide
IUPAC Name: 4-[[2-[[4-(dimethylsulfamoyl)phenyl]methylamino]ethylamino]methyl]-N,N-dimethylbenzenesulfonamide
SYSTEMATIC NAME: 4-[[2-[[4-(dimethylsulfamoyl)phenyl]methylamino]ethylamino]methyl]-N,N-dimethyl-benzenesulfonamide
MOLECULAR FORMULA: C20H30N4O4S2
MOLECULAR WEIGHT: 454.6066
SMILES: CN(C)S(=O)(=O)C1=CC=C(C=C1)CNCCNCC2=CC=C(C=C2)S(=O)(=O)N(C)C
Structure:
CAS RN: 4233-96-9
CAS Name: 3,4,5-trihydroxybenzoic acid [(2S,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl] ester
OPENEYE Name: [(2S,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)chroman-3-yl] 3,4,5-trihydroxybenzoate
IUPAC Name: [(2S,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
SYSTEMATIC NAME: [(2S,3R)-5,7-bis(oxidanyl)-2-[3,4,5-tris(oxidanyl)phenyl]-3,4-dihydro-2H-chromen-3-yl] 3,4,5-tris(oxidanyl)benzoate
MOLECULAR FORMULA: C22H18O11
MOLECULAR WEIGHT: 458.37172
SMILES: C1[C@H]([C@@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O
Structure:
CAS RN: 4233-13-0
CAS Name: [butyl(phenyl)phosphoryl]benzene
OPENEYE Name: [butyl(phenyl)phosphoryl]benzene
IUPAC Name: [butyl(phenyl)phosphoryl]benzene
SYSTEMATIC NAME: [butyl(phenyl)phosphoryl]benzene
MOLECULAR FORMULA: C16H19OP
MOLECULAR WEIGHT: 258.295221
SMILES: CCCCP(=O)(C1=CC=CC=C1)C2=CC=CC=C2
Structure:
CAS RN: 4232-84-2
CAS Name: phosphoric acid tris(4-aminophenyl) ester
OPENEYE Name: tris(4-aminophenyl) phosphate
IUPAC Name: tris(4-aminophenyl) phosphate
SYSTEMATIC NAME: tris(4-aminophenyl) phosphate
MOLECULAR FORMULA: C18H18N3O4P
MOLECULAR WEIGHT: 371.326981
SMILES: C1=CC(=CC=C1N)OP(=O)(OC2=CC=C(C=C2)N)OC3=CC=C(C=C3)N
Structure:
CAS RN: 4227-23-0
CAS Name: 8-ethyl-7-hydroxy-1,3-dimethylpurine-2,6-dione
OPENEYE Name: 8-ethyl-7-hydroxy-1,3-dimethyl-purine-2,6-dione
IUPAC Name: 8-ethyl-7-hydroxy-1,3-dimethylpurine-2,6-dione
SYSTEMATIC NAME: 8-ethyl-1,3-dimethyl-7-oxidanyl-purine-2,6-dione
MOLECULAR FORMULA: C9H12N4O3
MOLECULAR WEIGHT: 224.21658
SMILES: CCC1=NC2=C(N1O)C(=O)N(C(=O)N2C)C
Structure:
CAS RN: 4226-37-3
CAS Name: 2-(2-chloroethyl)pyridine hydrochloride
OPENEYE Name: 2-(2-chloroethyl)pyridine hydrochloride
IUPAC Name: 2-(2-chloroethyl)pyridine hydrochloride
SYSTEMATIC NAME: 2-(2-chloroethyl)pyridine hydrochloride
MOLECULAR FORMULA: C7H9Cl2N
MOLECULAR WEIGHT: 178.05906
SMILES: C1=CC=NC(=C1)CCCl.Cl
Structure:
CAS RN: 4226-36-2
CAS Name: 3-(2-chloroethyl)pyridine hydrochloride
OPENEYE Name: 3-(2-chloroethyl)pyridine hydrochloride
IUPAC Name: 3-(2-chloroethyl)pyridine hydrochloride
SYSTEMATIC NAME: 3-(2-chloroethyl)pyridine hydrochloride
MOLECULAR FORMULA: C7H9Cl2N
MOLECULAR WEIGHT: 178.05906
SMILES: C1=CC(=CN=C1)CCCl.Cl
Structure:
CAS RN: 4224-15-1
CAS Name: 3-(1-ethyl-1-piperidin-1-iumyl)-1-[4-[3-(1-ethyl-1-piperidin-1-iumyl)-1-oxopropyl]-1-piperazinyl]-1-propanone dibromide
OPENEYE Name: 3-(1-ethylpiperidin-1-ium-1-yl)-1-[4-[3-(1-ethylpiperidin-1-ium-1-yl)propanoyl]piperazin-1-yl]propan-1-one dibromide
IUPAC Name: 3-(1-ethylpiperidin-1-ium-1-yl)-1-[4-[3-(1-ethylpiperidin-1-ium-1-yl)propanoyl]piperazin-1-yl]propan-1-one dibromide
SYSTEMATIC NAME: 3-(1-ethylpiperidin-1-ium-1-yl)-1-[4-[3-(1-ethylpiperidin-1-ium-1-yl)propanoyl]piperazin-1-yl]propan-1-one dibromide
MOLECULAR FORMULA: C24H46Br2N4O2
MOLECULAR WEIGHT: 582.45564
SMILES: CC[N+]1(CCCCC1)CCC(=O)N2CCN(CC2)C(=O)CC[N+]3(CCCCC3)CC.[Br-].[Br-]
Structure:
CAS RN: 4223-93-2
CAS Name: 4-methyl-1-piperazinecarboxylic acid 2-(diethylamino)ethyl ester
OPENEYE Name: 2-(diethylamino)ethyl 4-methylpiperazine-1-carboxylate
IUPAC Name: 2-(diethylamino)ethyl 4-methylpiperazine-1-carboxylate
SYSTEMATIC NAME: 2-(diethylamino)ethyl 4-methylpiperazine-1-carboxylate
MOLECULAR FORMULA: C12H25N3O2
MOLECULAR WEIGHT: 243.3458
SMILES: CCN(CC)CCOC(=O)N1CCN(CC1)C
Structure:
CAS RN: 4220-10-4
CAS Name: (1-methyl-4-phenyl-4-piperidinyl)methanol
OPENEYE Name: (1-methyl-4-phenyl-4-piperidyl)methanol
IUPAC Name: (1-methyl-4-phenylpiperidin-4-yl)methanol
SYSTEMATIC NAME: (1-methyl-4-phenyl-piperidin-4-yl)methanol
MOLECULAR FORMULA: C13H19NO
MOLECULAR WEIGHT: 205.29606
SMILES: CN1CCC(CC1)(CO)C2=CC=CC=C2
Structure:
CAS RN: 4219-99-2
CAS Name: 1,5-dicyclohexyl-5-(dimethylamino)-4,4-dimethyl-1-pentanone; 2-hydroxypropane-1,2,3-tricarboxylic acid
OPENEYE Name: citric acid; 1,5-dicyclohexyl-5-(dimethylamino)-4,4-dimethyl-pentan-1-one
IUPAC Name: 1,5-dicyclohexyl-5-(dimethylamino)-4,4-dimethylpentan-1-one; 2-hydroxypropane-1,2,3-tricarboxylic acid
SYSTEMATIC NAME: 1,5-dicyclohexyl-5-(dimethylamino)-4,4-dimethyl-pentan-1-one; 2-oxidanylpropane-1,2,3-tricarboxylic acid
MOLECULAR FORMULA: C27H47NO8
MOLECULAR WEIGHT: 513.66398
SMILES: CC(C)(CCC(=O)C1CCCCC1)C(C2CCCCC2)N(C)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
Structure:
CAS RN: 4210-71-3
CAS Name: 2-(4-chlorophenoxy)acetic acid 2-(dimethylamino)propyl ester
OPENEYE Name: 2-(dimethylamino)propyl 2-(4-chlorophenoxy)acetate
IUPAC Name: 2-(dimethylamino)propyl 2-(4-chlorophenoxy)acetate
SYSTEMATIC NAME: 2-(dimethylamino)propyl 2-(4-chloranylphenoxy)ethanoate
MOLECULAR FORMULA: C13H18ClNO3
MOLECULAR WEIGHT: 271.73992
SMILES: CC(COC(=O)COC1=CC=C(C=C1)Cl)N(C)C
Structure:
CAS RN: 13164-89-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H20N4O5
MOLECULAR WEIGHT: 360.3645
SMILES: CC1=C(C(=O)C2=C(C1=O)N3C[C@H]4[C@@H]([C@@]3([C@@H]2COC(=O)N)O)N4C)N5CC5
Structure:
CAS RN: 17269-54-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H20N4O5
MOLECULAR WEIGHT: 360.3645
SMILES: CC1=C(C(=O)C2=C(C1=O)N3C[C@H]4[C@@H]([C@@]3([C@@H]2COC(=O)N)O)N4C)N5CC5
Structure:
CAS RN: 27086-04-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H20N4O5
MOLECULAR WEIGHT: 360.3645
SMILES: CC1=C(C(=O)C2=C(C1=O)N3C[C@H]4[C@@H]([C@@]3([C@@H]2COC(=O)N)O)N4C)N5CC5
Structure:
CAS RN: 4206-89-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H20N4O5
MOLECULAR WEIGHT: 360.3645
SMILES: CC1=C(C(=O)C2=C(C1=O)N3C[C@H]4[C@@H]([C@@]3([C@@H]2COC(=O)N)O)N4C)N5CC5
Structure:
CAS RN: 4195-39-5
CAS Name: 2-(4-chlorophenoxy)ethanethioic acid S-[2-(diethylamino)ethyl] ester
OPENEYE Name: S-[2-(diethylamino)ethyl] 2-(4-chlorophenoxy)ethanethioate
IUPAC Name: S-[2-(diethylamino)ethyl] 2-(4-chlorophenoxy)ethanethioate
SYSTEMATIC NAME: S-[2-(diethylamino)ethyl] 2-(4-chloranylphenoxy)ethanethioate
MOLECULAR FORMULA: C14H20ClNO2S
MOLECULAR WEIGHT: 301.8321
SMILES: CCN(CC)CCSC(=O)COC1=CC=C(C=C1)Cl
Structure:
CAS RN: 4195-37-3
CAS Name: 2-(4-chlorophenoxy)acetic acid 2-(diethylamino)propyl ester
OPENEYE Name: 2-(diethylamino)propyl 2-(4-chlorophenoxy)acetate
IUPAC Name: 2-(diethylamino)propyl 2-(4-chlorophenoxy)acetate
SYSTEMATIC NAME: 2-(diethylamino)propyl 2-(4-chloranylphenoxy)ethanoate
MOLECULAR FORMULA: C15H22ClNO3
MOLECULAR WEIGHT: 299.79308
SMILES: CCN(CC)C(C)COC(=O)COC1=CC=C(C=C1)Cl
Structure:
CAS RN: 4195-36-2
CAS Name: 2-(4-chlorophenoxy)acetic acid 1-(diethylamino)propan-2-yl ester
OPENEYE Name: [2-(diethylamino)-1-methyl-ethyl] 2-(4-chlorophenoxy)acetate
IUPAC Name: 1-(diethylamino)propan-2-yl 2-(4-chlorophenoxy)acetate
SYSTEMATIC NAME: 1-(diethylamino)propan-2-yl 2-(4-chloranylphenoxy)ethanoate
MOLECULAR FORMULA: C15H22ClNO3
MOLECULAR WEIGHT: 299.79308
SMILES: CCN(CC)CC(C)OC(=O)COC1=CC=C(C=C1)Cl
Structure:
CAS RN: 4192-36-3
CAS Name: 1-(4-hydroxycyclohexyl)-5-pentyl-1,3-diazinane-2,4,6-trione
OPENEYE Name: 1-(4-hydroxycyclohexyl)-5-pentyl-hexahydropyrimidine-2,4,6-trione
IUPAC Name: 1-(4-hydroxycyclohexyl)-5-pentyl-1,3-diazinane-2,4,6-trione
SYSTEMATIC NAME: 1-(4-oxidanylcyclohexyl)-5-pentyl-1,3-diazinane-2,4,6-trione
MOLECULAR FORMULA: C15H24N2O4
MOLECULAR WEIGHT: 296.36206
SMILES: CCCCCC1C(=O)NC(=O)N(C1=O)C2CCC(CC2)O
Structure:
CAS RN: 4192-35-2
CAS Name: 1-(4-hydroxycyclohexyl)-5-methyl-1,3-diazinane-2,4,6-trione
OPENEYE Name: 1-(4-hydroxycyclohexyl)-5-methyl-hexahydropyrimidine-2,4,6-trione
IUPAC Name: 1-(4-hydroxycyclohexyl)-5-methyl-1,3-diazinane-2,4,6-trione
SYSTEMATIC NAME: 5-methyl-1-(4-oxidanylcyclohexyl)-1,3-diazinane-2,4,6-trione
MOLECULAR FORMULA: C11H16N2O4
MOLECULAR WEIGHT: 240.25574
SMILES: CC1C(=O)NC(=O)N(C1=O)C2CCC(CC2)O
Structure:
CAS RN: 4189-78-0
CAS Name: 3-(dimethylamino)-2-methyl-1-(4-methylphenyl)-1-phenyl-1-propanol; oxalic acid
OPENEYE Name: 3-(dimethylamino)-2-methyl-1-phenyl-1-(p-tolyl)propan-1-ol; oxalic acid
IUPAC Name: 3-(dimethylamino)-2-methyl-1-(4-methylphenyl)-1-phenylpropan-1-ol; oxalic acid
SYSTEMATIC NAME: 3-(dimethylamino)-2-methyl-1-(4-methylphenyl)-1-phenyl-propan-1-ol; ethanedioic acid
MOLECULAR FORMULA: C21H27NO5
MOLECULAR WEIGHT: 373.44278
SMILES: CC1=CC=C(C=C1)C(C2=CC=CC=C2)(C(C)CN(C)C)O.C(=O)(C(=O)O)O
Structure:
CAS RN: 4187-88-6
CAS Name: 1-cyclohexyl-2-propyn-1-ol
OPENEYE Name: 1-cyclohexylprop-2-yn-1-ol
IUPAC Name: 1-cyclohexylprop-2-yn-1-ol
SYSTEMATIC NAME: 1-cyclohexylprop-2-yn-1-ol
MOLECULAR FORMULA: C9H14O
MOLECULAR WEIGHT: 138.20686
SMILES: C#CC(C1CCCCC1)O
Structure:
CAS RN: 4186-17-8
CAS Name: 1-(diethoxyphosphorylthio)-2,2-bis(ethylthio)propane
OPENEYE Name: 1-diethoxyphosphorylsulfanyl-2,2-bis(ethylsulfanyl)propane
IUPAC Name: 1-diethoxyphosphorylsulfanyl-2,2-bis(ethylsulfanyl)propane
SYSTEMATIC NAME: 1-diethoxyphosphorylsulfanyl-2,2-bis(ethylsulfanyl)propane
MOLECULAR FORMULA: C11H25O3PS3
MOLECULAR WEIGHT: 332.483161
SMILES: CCOP(=O)(OCC)SCC(C)(SCC)SCC
Structure:
CAS RN: 4180-39-6
CAS Name: N-[bis(1-aziridinyl)phosphoryl]-3,4-diiodobenzamide
OPENEYE Name: N-[bis(aziridin-1-yl)phosphoryl]-3,4-diiodo-benzamide
IUPAC Name: N-[bis(aziridin-1-yl)phosphoryl]-3,4-diiodobenzamide
SYSTEMATIC NAME: N-[bis(aziridin-1-yl)phosphoryl]-3,4-bis(iodanyl)benzamide
MOLECULAR FORMULA: C11H12I2N3O2P
MOLECULAR WEIGHT: 503.014581
SMILES: C1CN1P(=O)(NC(=O)C2=CC(=C(C=C2)I)I)N3CC3
Structure:
CAS RN: 4177-35-9
CAS Name: 3-methyl-4-(4-phenyl-1-piperazinyl)-9-bicyclo[3.3.1]nonanone
OPENEYE Name: 3-methyl-4-(4-phenylpiperazin-1-yl)bicyclo[3.3.1]nonan-9-one
IUPAC Name: 3-methyl-4-(4-phenylpiperazin-1-yl)bicyclo[3.3.1]nonan-9-one
SYSTEMATIC NAME: 3-methyl-4-(4-phenylpiperazin-1-yl)bicyclo[3.3.1]nonan-9-one
MOLECULAR FORMULA: C20H28N2O
MOLECULAR WEIGHT: 312.44912
SMILES: CC1CC2CCCC(C1N3CCN(CC3)C4=CC=CC=C4)C2=O
Structure:
CAS RN: 4177-23-5
CAS Name: 2-phenyl-4-(4-phenyl-1-piperazinyl)-9-bicyclo[3.3.1]nonanone
OPENEYE Name: 2-phenyl-4-(4-phenylpiperazin-1-yl)bicyclo[3.3.1]nonan-9-one
IUPAC Name: 2-phenyl-4-(4-phenylpiperazin-1-yl)bicyclo[3.3.1]nonan-9-one
SYSTEMATIC NAME: 2-phenyl-4-(4-phenylpiperazin-1-yl)bicyclo[3.3.1]nonan-9-one
MOLECULAR FORMULA: C25H30N2O
MOLECULAR WEIGHT: 374.5185
SMILES: C1CC2C(CC(C(C1)C2=O)N3CCN(CC3)C4=CC=CC=C4)C5=CC=CC=C5
Structure:
CAS RN: 4177-22-4
CAS Name: 7-(4-phenyl-1-piperazinyl)-10-bicyclo[4.3.1]decanone
OPENEYE Name: 7-(4-phenylpiperazin-1-yl)bicyclo[4.3.1]decan-10-one
IUPAC Name: 7-(4-phenylpiperazin-1-yl)bicyclo[4.3.1]decan-10-one
SYSTEMATIC NAME: 7-(4-phenylpiperazin-1-yl)bicyclo[4.3.1]decan-10-one
MOLECULAR FORMULA: C20H28N2O
MOLECULAR WEIGHT: 312.44912
SMILES: C1CCC2C(CCC(C1)C2=O)N3CCN(CC3)C4=CC=CC=C4
Structure:
CAS RN: 4174-69-0
CAS Name: 3-[2-[(3-amino-5-ethyl-6-phenyl-8-phenanthridin-5-iumyl)imino]hydrazinyl]benzenecarboximidamide bromide hydrobromide
OPENEYE Name: 3-[2-(3-amino-5-ethyl-6-phenyl-phenanthridin-5-ium-8-yl)iminohydrazino]benzamidine bromide hydrobromide
IUPAC Name: 3-[2-(3-amino-5-ethyl-6-phenylphenanthridin-5-ium-8-yl)iminohydrazinyl]benzenecarboximidamide bromide hydrobromide
SYSTEMATIC NAME: 3-[2-(3-azanyl-5-ethyl-6-phenyl-phenanthridin-5-ium-8-yl)iminohydrazinyl]benzenecarboximidamide bromide hydrobromide
MOLECULAR FORMULA: C28H27Br2N7
MOLECULAR WEIGHT: 621.36888
SMILES: CC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N=NNC5=CC=CC(=C5)C(=N)N)N.Br.[Br-]
Structure:
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