CAS RN: 5342-20-1
CAS Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-5,7-dinitro-2,1,3-benzoxadiazol-4-amine
OPENEYE Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-5,7-dinitro-2,1,3-benzoxadiazol-4-amine
IUPAC Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-5,7-dinitro-2,1,3-benzoxadiazol-4-amine
SYSTEMATIC NAME: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-5,7-dinitro-2,1,3-benzoxadiazol-4-amine
MOLECULAR FORMULA: C13H5ClF3N5O5
MOLECULAR WEIGHT: 403.65751
SMILES: C1=CC(=C(C=C1C(F)(F)F)NC2=C(C=C(C3=NON=C23)[N+](=O)[O-])[N+](=O)[O-])Cl
Structure:
CAS RN: 5341-78-6
CAS Name: 1-hydroxy-7a-methyl-2-(4-nitrophenyl)-4,5,6,7-tetrahydro-2H-benzimidazole
OPENEYE Name: 1-hydroxy-7a-methyl-2-(4-nitrophenyl)-4,5,6,7-tetrahydro-2H-benzimidazole
IUPAC Name: 1-hydroxy-7a-methyl-2-(4-nitrophenyl)-4,5,6,7-tetrahydro-2H-benzimidazole
SYSTEMATIC NAME: 7a-methyl-2-(4-nitrophenyl)-1-oxidanyl-4,5,6,7-tetrahydro-2H-benzimidazole
MOLECULAR FORMULA: C14H17N3O3
MOLECULAR WEIGHT: 275.30308
SMILES: CC12CCCCC1=NC(N2O)C3=CC=C(C=C3)[N+](=O)[O-]
Structure:
CAS RN: 5339-81-1
CAS Name: 6-acetyl-5-phenyl-3-thiophen-2-yl-1-cyclohex-2-enone
OPENEYE Name: 6-acetyl-5-phenyl-3-(2-thienyl)cyclohex-2-en-1-one
IUPAC Name: 6-acetyl-5-phenyl-3-thiophen-2-ylcyclohex-2-en-1-one
SYSTEMATIC NAME: 6-ethanoyl-5-phenyl-3-thiophen-2-yl-cyclohex-2-en-1-one
MOLECULAR FORMULA: C18H16O2S
MOLECULAR WEIGHT: 296.38344
SMILES: CC(=O)C1C(CC(=CC1=O)C2=CC=CS2)C3=CC=CC=C3
Structure:
CAS RN: 5339-66-2
CAS Name: 4-(4-phenylphenoxy)-6-(1-pyrazolyl)pyrimidine
OPENEYE Name: 4-(4-phenylphenoxy)-6-pyrazol-1-yl-pyrimidine
IUPAC Name: 4-(4-phenylphenoxy)-6-pyrazol-1-ylpyrimidine
SYSTEMATIC NAME: 4-(4-phenylphenoxy)-6-pyrazol-1-yl-pyrimidine
MOLECULAR FORMULA: C19H14N4O
MOLECULAR WEIGHT: 314.34066
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)OC3=NC=NC(=C3)N4C=CC=N4
Structure:
CAS RN: 5335-13-7
CAS Name: 2,2-dichloro-N-(1-phenylethyl)acetamide
OPENEYE Name: 2,2-dichloro-N-(1-phenylethyl)acetamide
IUPAC Name: 2,2-dichloro-N-(1-phenylethyl)acetamide
SYSTEMATIC NAME: 2,2-bis(chloranyl)-N-(1-phenylethyl)ethanamide
MOLECULAR FORMULA: C10H11Cl2NO
MOLECULAR WEIGHT: 232.10644
SMILES: CC(C1=CC=CC=C1)NC(=O)C(Cl)Cl
Structure:
CAS RN: 5333-25-5
CAS Name: 1-[4-(4-nitrophenyl)-1-piperazinyl]-3-phenoxy-2-propanol
OPENEYE Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-3-phenoxy-propan-2-ol
IUPAC Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-3-phenoxypropan-2-ol
SYSTEMATIC NAME: 1-[4-(4-nitrophenyl)piperazin-1-yl]-3-phenoxy-propan-2-ol
MOLECULAR FORMULA: C19H23N3O4
MOLECULAR WEIGHT: 357.40362
SMILES: C1CN(CCN1CC(COC2=CC=CC=C2)O)C3=CC=C(C=C3)[N+](=O)[O-]
Structure:
CAS RN: 5326-67-0
CAS Name: 4-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-(4-hydroxyphenyl)methyl]-1,5-dimethyl-2-phenyl-3-pyrazolone
OPENEYE Name: 4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-(4-hydroxyphenyl)methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one
IUPAC Name: 4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-(4-hydroxyphenyl)methyl]-1,5-dimethyl-2-phenylpyrazol-3-one
SYSTEMATIC NAME: 4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-(4-hydroxyphenyl)methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one
MOLECULAR FORMULA: C29H28N4O3
MOLECULAR WEIGHT: 480.55762
SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(C3=CC=C(C=C3)O)C4=C(N(N(C4=O)C5=CC=CC=C5)C)C
Structure:
CAS RN: 5326-65-8
CAS Name: 4-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-(4-methylphenyl)methyl]-1,5-dimethyl-2-phenyl-3-pyrazolone
OPENEYE Name: 4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-(p-tolyl)methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one
IUPAC Name: 4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-(4-methylphenyl)methyl]-1,5-dimethyl-2-phenylpyrazol-3-one
SYSTEMATIC NAME: 4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-(4-methylphenyl)methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one
MOLECULAR FORMULA: C30H30N4O2
MOLECULAR WEIGHT: 478.5848
SMILES: CC1=CC=C(C=C1)C(C2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C4=C(N(N(C4=O)C5=CC=CC=C5)C)C
Structure:
CAS RN: 5325-98-4
CAS Name: 6-(3-hydroxy-4-methoxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
OPENEYE Name: 6-(3-hydroxy-4-methoxy-phenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
IUPAC Name: 6-(3-hydroxy-4-methoxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
SYSTEMATIC NAME: 6-(4-methoxy-3-oxidanyl-phenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
MOLECULAR FORMULA: C22H24N2O3
MOLECULAR WEIGHT: 364.43756
SMILES: CC1(CC2=C(C(NC3=CC=CC=C3N2)C4=CC(=C(C=C4)OC)O)C(=O)C1)C
Structure:
CAS RN: 5325-58-6
CAS Name: 1-tert-butyl-3-[5-[[(tert-butylamino)-oxomethyl]amino]-1,3-dimethyl-2-oxo-4-imidazolidinyl]urea
OPENEYE Name: 1-tert-butyl-3-[5-(tert-butylcarbamoylamino)-1,3-dimethyl-2-oxo-imidazolidin-4-yl]urea
IUPAC Name: 1-tert-butyl-3-[5-(tert-butylcarbamoylamino)-1,3-dimethyl-2-oxoimidazolidin-4-yl]urea
SYSTEMATIC NAME: 1-tert-butyl-3-[5-(tert-butylcarbamoylamino)-1,3-dimethyl-2-oxidanylidene-imidazolidin-4-yl]urea
MOLECULAR FORMULA: C15H30N6O3
MOLECULAR WEIGHT: 342.4371
SMILES: CC(C)(C)NC(=O)NC1C(N(C(=O)N1C)C)NC(=O)NC(C)(C)C
Structure:
CAS RN: 5325-42-8
CAS Name: 2-propan-2-ylfuro[3,2-g][1]benzopyran-3,7-dione
OPENEYE Name: 2-isopropylfuro[3,2-g]chromene-3,7-dione
IUPAC Name: 2-propan-2-ylfuro[3,2-g]chromene-3,7-dione
SYSTEMATIC NAME: 2-propan-2-ylfuro[3,2-g]chromene-3,7-dione
MOLECULAR FORMULA: C14H12O4
MOLECULAR WEIGHT: 244.24268
SMILES: CC(C)C1C(=O)C2=C(O1)C=C3C(=C2)C=CC(=O)O3
Structure:
CAS RN: 21311-66-0
CAS Name: 3-methylbutanoic acid (10-acetyloxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-f][1]benzopyran-9-yl) ester
OPENEYE Name: (10-acetoxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl) 3-methylbutanoate
IUPAC Name: (10-acetyloxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl) 3-methylbutanoate
SYSTEMATIC NAME: (10-acetyloxy-8,8-dimethyl-2-oxidanylidene-9,10-dihydropyrano[2,3-f]chromen-9-yl) 3-methylbutanoate
MOLECULAR FORMULA: C21H24O7
MOLECULAR WEIGHT: 388.41106
SMILES: CC(C)CC(=O)OC1C(C2=C(C=CC3=C2OC(=O)C=C3)OC1(C)C)OC(=O)C
Structure:
CAS RN: 5323-09-1
CAS Name: 1-(4-bromophenyl)-3-(3,5-dimethyl-1-pyrazolyl)pyrrolidine-2,5-dione
OPENEYE Name: 1-(4-bromophenyl)-3-(3,5-dimethylpyrazol-1-yl)pyrrolidine-2,5-dione
IUPAC Name: 1-(4-bromophenyl)-3-(3,5-dimethylpyrazol-1-yl)pyrrolidine-2,5-dione
SYSTEMATIC NAME: 1-(4-bromophenyl)-3-(3,5-dimethylpyrazol-1-yl)pyrrolidine-2,5-dione
MOLECULAR FORMULA: C15H14BrN3O2
MOLECULAR WEIGHT: 348.19456
SMILES: CC1=CC(=NN1C2CC(=O)N(C2=O)C3=CC=C(C=C3)Br)C
Structure:
CAS RN: 117491-03-9
CAS Name: 2-[[5-acetyl-4-(4-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]thio]acetamide
OPENEYE Name: 2-[[5-acetyl-4-(4-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]acetamide
IUPAC Name: 2-[[5-acetyl-4-(4-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]acetamide
SYSTEMATIC NAME: 2-[[4-(4-chlorophenyl)-3-cyano-5-ethanoyl-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]ethanamide
MOLECULAR FORMULA: C17H16ClN3O2S
MOLECULAR WEIGHT: 361.84584
SMILES: CC1=C(C(C(=C(N1)SCC(=O)N)C#N)C2=CC=C(C=C2)Cl)C(=O)C
Structure:
CAS RN: 5322-41-8
CAS Name: 5-[4-(dimethylamino)phenyl]-3-phenyl-3,4-dihydropyrazole-2-carboxaldehyde
OPENEYE Name: 5-[4-(dimethylamino)phenyl]-3-phenyl-3,4-dihydropyrazole-2-carbaldehyde
IUPAC Name: 5-[4-(dimethylamino)phenyl]-3-phenyl-3,4-dihydropyrazole-2-carbaldehyde
SYSTEMATIC NAME: 5-[4-(dimethylamino)phenyl]-3-phenyl-3,4-dihydropyrazole-2-carbaldehyde
MOLECULAR FORMULA: C18H19N3O
MOLECULAR WEIGHT: 293.36296
SMILES: CN(C)C1=CC=C(C=C1)C2=NN(C(C2)C3=CC=CC=C3)C=O
Structure:
CAS RN: 5322-28-1
CAS Name: 1-phenyl-2-[(phenylmethylene)amino]ethanol
OPENEYE Name: 2-(benzylideneamino)-1-phenyl-ethanol
IUPAC Name: 2-(benzylideneamino)-1-phenylethanol
SYSTEMATIC NAME: 1-phenyl-2-[(phenylmethylidene)amino]ethanol
MOLECULAR FORMULA: C15H15NO
MOLECULAR WEIGHT: 225.2857
SMILES: C1=CC=C(C=C1)C=NCC(C2=CC=CC=C2)O
Structure:
CAS RN: 5321-93-7
CAS Name: 4-(2-chlorophenyl)-5-cyano-2-methyl-N-(2-methylphenyl)-6-(methylthio)-1,4-dihydropyridine-3-carboxamide
OPENEYE Name: 4-(2-chlorophenyl)-5-cyano-2-methyl-6-methylsulfanyl-N-(o-tolyl)-1,4-dihydropyridine-3-carboxamide
IUPAC Name: 4-(2-chlorophenyl)-5-cyano-2-methyl-N-(2-methylphenyl)-6-methylsulfanyl-1,4-dihydropyridine-3-carboxamide
SYSTEMATIC NAME: 4-(2-chlorophenyl)-5-cyano-2-methyl-N-(2-methylphenyl)-6-methylsulfanyl-1,4-dihydropyridine-3-carboxamide
MOLECULAR FORMULA: C22H20ClN3OS
MOLECULAR WEIGHT: 409.9317
SMILES: CC1=CC=CC=C1NC(=O)C2=C(NC(=C(C2C3=CC=CC=C3Cl)C#N)SC)C
Structure:
CAS RN: 5321-73-3
CAS Name: 6,8-dibromo-5'-methylspiro[1-benzopyran-2,6'-phenanthridine]
OPENEYE Name: 6,8-dibromo-5'-methyl-spiro[chromene-2,6'-phenanthridine]
IUPAC Name: 6,8-dibromo-5'-methylspiro[chromene-2,6'-phenanthridine]
SYSTEMATIC NAME: 6,8-bis(bromanyl)-5'-methyl-spiro[chromene-2,6'-phenanthridine]
MOLECULAR FORMULA: C22H15Br2NO
MOLECULAR WEIGHT: 469.1686
SMILES: CN1C2=CC=CC=C2C3=CC=CC=C3C14C=CC5=CC(=CC(=C5O4)Br)Br
Structure:
CAS RN: 5321-12-0
CAS Name: 1-(3,6-diiodo-9-carbazolyl)-3-(1-piperidinyl)-2-propanol
OPENEYE Name: 1-(3,6-diiodocarbazol-9-yl)-3-(1-piperidyl)propan-2-ol
IUPAC Name: 1-(3,6-diiodocarbazol-9-yl)-3-piperidin-1-ylpropan-2-ol
SYSTEMATIC NAME: 1-[3,6-bis(iodanyl)carbazol-9-yl]-3-piperidin-1-yl-propan-2-ol
MOLECULAR FORMULA: C20H22I2N2O
MOLECULAR WEIGHT: 560.21042
SMILES: C1CCN(CC1)CC(CN2C3=C(C=C(C=C3)I)C4=C2C=CC(=C4)I)O
Structure:
CAS RN: 5320-69-4
CAS Name: 5-acetyl-4-(2-chlorophenyl)-2-[[2-(2,4-dimethylphenyl)-2-oxoethyl]thio]-6-methyl-1,4-dihydropyridine-3-carbonitrile
OPENEYE Name: 5-acetyl-4-(2-chlorophenyl)-2-[2-(2,4-dimethylphenyl)-2-oxo-ethyl]sulfanyl-6-methyl-1,4-dihydropyridine-3-carbonitrile
IUPAC Name: 5-acetyl-4-(2-chlorophenyl)-2-[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl-6-methyl-1,4-dihydropyridine-3-carbonitrile
SYSTEMATIC NAME: 4-(2-chlorophenyl)-2-[2-(2,4-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-5-ethanoyl-6-methyl-1,4-dihydropyridine-3-carbonitrile
MOLECULAR FORMULA: C25H23ClN2O2S
MOLECULAR WEIGHT: 450.98032
SMILES: CC1=CC(=C(C=C1)C(=O)CSC2=C(C(C(=C(N2)C)C(=O)C)C3=CC=CC=C3Cl)C#N)C
Structure:
CAS RN: 5319-26-6
CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)-N,N-dimethylpropanamide
OPENEYE Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)-N,N-dimethyl-propanamide
IUPAC Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)-N,N-dimethylpropanamide
SYSTEMATIC NAME: 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-N,N-dimethyl-propanamide
MOLECULAR FORMULA: C19H31NO2
MOLECULAR WEIGHT: 305.45494
SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)N(C)C
Structure:
CAS RN: 5319-19-7
CAS Name: 2-(3-methyl-1-imidazol-3-iumyl)-1-phenylethanone chloride
OPENEYE Name: 2-(3-methylimidazol-3-ium-1-yl)-1-phenyl-ethanone chloride
IUPAC Name: 2-(3-methylimidazol-3-ium-1-yl)-1-phenylethanone chloride
SYSTEMATIC NAME: 2-(3-methylimidazol-3-ium-1-yl)-1-phenyl-ethanone chloride
MOLECULAR FORMULA: C12H13ClN2O
MOLECULAR WEIGHT: 236.69742
SMILES: C[N+]1=CN(C=C1)CC(=O)C2=CC=CC=C2.[Cl-]
Structure:
CAS RN: 117491-01-7
CAS Name: 5-acetyl-4-(4-chlorophenyl)-6-methyl-2-(methylthio)-1,4-dihydropyridine-3-carbonitrile
OPENEYE Name: 5-acetyl-4-(4-chlorophenyl)-6-methyl-2-methylsulfanyl-1,4-dihydropyridine-3-carbonitrile
IUPAC Name: 5-acetyl-4-(4-chlorophenyl)-6-methyl-2-methylsulfanyl-1,4-dihydropyridine-3-carbonitrile
SYSTEMATIC NAME: 4-(4-chlorophenyl)-5-ethanoyl-6-methyl-2-methylsulfanyl-1,4-dihydropyridine-3-carbonitrile
MOLECULAR FORMULA: C16H15ClN2OS
MOLECULAR WEIGHT: 318.8211
SMILES: CC1=C(C(C(=C(N1)SC)C#N)C2=CC=C(C=C2)Cl)C(=O)C
Structure:
CAS RN: 5317-69-1
CAS Name: 2'-amino-6-bromo-5,7'-dimethyl-2,5'-dioxo-3'-spiro[1H-indole-3,4'-pyrano[4,3-b]pyran]carbonitrile
OPENEYE Name: 2'-amino-6-bromo-5,7'-dimethyl-2,5'-dioxo-spiro[indoline-3,4'-pyrano[4,3-b]pyran]-3'-carbonitrile
IUPAC Name: 2'-amino-6-bromo-5,7'-dimethyl-2,5'-dioxospiro[1H-indole-3,4'-pyrano[4,3-b]pyran]-3'-carbonitrile
SYSTEMATIC NAME: 2'-azanyl-6-bromanyl-5,7'-dimethyl-2,5'-bis(oxidanylidene)spiro[1H-indole-3,4'-pyrano[4,3-b]pyran]-3'-carbonitrile
MOLECULAR FORMULA: C18H12BrN3O4
MOLECULAR WEIGHT: 414.20958
SMILES: CC1=CC2=C(C(=O)O1)C3(C4=CC(=C(C=C4NC3=O)Br)C)C(=C(O2)N)C#N
Structure:
CAS RN: 5316-97-2
CAS Name: (3,5-diphenyl-3,4-dihydropyrazol-2-yl)-phenylmethanone
OPENEYE Name: (3,5-diphenyl-3,4-dihydropyrazol-2-yl)-phenyl-methanone
IUPAC Name: (3,5-diphenyl-3,4-dihydropyrazol-2-yl)-phenylmethanone
SYSTEMATIC NAME: (3,5-diphenyl-3,4-dihydropyrazol-2-yl)-phenyl-methanone
MOLECULAR FORMULA: C22H18N2O
MOLECULAR WEIGHT: 326.39112
SMILES: C1C(N(N=C1C2=CC=CC=C2)C(=O)C3=CC=CC=C3)C4=CC=CC=C4
Structure:
CAS RN: 62236-09-3
CAS Name: 1-(5-amino-2-phenyl-2H-1,3,4-thiadiazol-3-yl)ethanone
OPENEYE Name: 1-(5-amino-2-phenyl-2H-1,3,4-thiadiazol-3-yl)ethanone
IUPAC Name: 1-(5-amino-2-phenyl-2H-1,3,4-thiadiazol-3-yl)ethanone
SYSTEMATIC NAME: 1-(5-azanyl-2-phenyl-2H-1,3,4-thiadiazol-3-yl)ethanone
MOLECULAR FORMULA: C10H11N3OS
MOLECULAR WEIGHT: 221.27884
SMILES: CC(=O)N1C(SC(=N1)N)C2=CC=CC=C2
Structure:
CAS RN: 5315-91-3
CAS Name: N-(2,6-dimethylphenyl)-2,6-difluoro-N-(phenylmethyl)benzamide
OPENEYE Name: N-benzyl-N-(2,6-dimethylphenyl)-2,6-difluoro-benzamide
IUPAC Name: N-benzyl-N-(2,6-dimethylphenyl)-2,6-difluorobenzamide
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-2,6-bis(fluoranyl)-N-(phenylmethyl)benzamide
MOLECULAR FORMULA: C22H19F2NO
MOLECULAR WEIGHT: 351.389166
SMILES: CC1=C(C(=CC=C1)C)N(CC2=CC=CC=C2)C(=O)C3=C(C=CC=C3F)F
Structure:
CAS RN: 56708-70-4
CAS Name: 1-(4-bromophenyl)-2-(2-isoquinolin-2-iumyl)ethanone bromide
OPENEYE Name: 1-(4-bromophenyl)-2-isoquinolin-2-ium-2-yl-ethanone bromide
IUPAC Name: 1-(4-bromophenyl)-2-isoquinolin-2-ium-2-ylethanone bromide
SYSTEMATIC NAME: 1-(4-bromophenyl)-2-isoquinolin-2-ium-2-yl-ethanone bromide
MOLECULAR FORMULA: C17H13Br2NO
MOLECULAR WEIGHT: 407.09922
SMILES: C1=CC=C2C=[N+](C=CC2=C1)CC(=O)C3=CC=C(C=C3)Br.[Br-]
Structure:
CAS RN: 5315-21-9
CAS Name: 3-(dimethylamino)-1-(4-ethoxyphenyl)-1-propanone hydrochloride
OPENEYE Name: 3-(dimethylamino)-1-(4-ethoxyphenyl)propan-1-one hydrochloride
IUPAC Name: 3-(dimethylamino)-1-(4-ethoxyphenyl)propan-1-one hydrochloride
SYSTEMATIC NAME: 3-(dimethylamino)-1-(4-ethoxyphenyl)propan-1-one hydrochloride
MOLECULAR FORMULA: C13H20ClNO2
MOLECULAR WEIGHT: 257.7564
SMILES: CCOC1=CC=C(C=C1)C(=O)CCN(C)C.Cl
Structure:
CAS RN: 5315-19-5
CAS Name: 2-[(2-ethoxyphenyl)-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione
OPENEYE Name: 2-[(2-ethoxyphenyl)-(2-hydroxy-4,4-dimethyl-6-oxo-cyclohexen-1-yl)methyl]-5,5-dimethyl-cyclohexane-1,3-dione
IUPAC Name: 2-[(2-ethoxyphenyl)-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione
SYSTEMATIC NAME: 2-[(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-(2-ethoxyphenyl)methyl]-5,5-dimethyl-cyclohexane-1,3-dione
MOLECULAR FORMULA: C25H32O5
MOLECULAR WEIGHT: 412.51858
SMILES: CCOC1=CC=CC=C1C(C2C(=O)CC(CC2=O)(C)C)C3=C(CC(CC3=O)(C)C)O
Structure:
CAS RN: 5315-04-8
CAS Name: 1-(4-chlorophenyl)-2-(1H-imidazol-3-ium-3-yl)ethanone chloride
OPENEYE Name: 1-(4-chlorophenyl)-2-(1H-imidazol-3-ium-3-yl)ethanone chloride
IUPAC Name: 1-(4-chlorophenyl)-2-(1H-imidazol-3-ium-3-yl)ethanone chloride
SYSTEMATIC NAME: 1-(4-chlorophenyl)-2-(1H-imidazol-3-ium-3-yl)ethanone chloride
MOLECULAR FORMULA: C11H10Cl2N2O
MOLECULAR WEIGHT: 257.1159
SMILES: C1=CC(=CC=C1C(=O)C[N+]2=CNC=C2)Cl.[Cl-]
Structure:
CAS RN: 5314-25-0
CAS Name: 2-[[5-acetyl-3-cyano-4-(4-hydroxyphenyl)-6-methyl-1,4-dihydropyridin-2-yl]thio]acetamide
OPENEYE Name: 2-[[5-acetyl-3-cyano-4-(4-hydroxyphenyl)-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]acetamide
IUPAC Name: 2-[[5-acetyl-3-cyano-4-(4-hydroxyphenyl)-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]acetamide
SYSTEMATIC NAME: 2-[[3-cyano-5-ethanoyl-4-(4-hydroxyphenyl)-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]ethanamide
MOLECULAR FORMULA: C17H17N3O3S
MOLECULAR WEIGHT: 343.40018
SMILES: CC1=C(C(C(=C(N1)SCC(=O)N)C#N)C2=CC=C(C=C2)O)C(=O)C
Structure:
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