CAS RN: 52546-86-8
CAS Name: [2-(2-methylphenyl)-1,4-diazaspiro[4.5]deca-1,3-dien-3-yl]hydrazine
OPENEYE Name: [2-(o-tolyl)-1,4-diazaspiro[4.5]deca-1,3-dien-3-yl]hydrazine
IUPAC Name: [2-(2-methylphenyl)-1,4-diazaspiro[4.5]deca-1,3-dien-3-yl]hydrazine
SYSTEMATIC NAME: [2-(2-methylphenyl)-1,4-diazaspiro[4.5]deca-1,3-dien-3-yl]diazane
MOLECULAR FORMULA: C15H20N4
MOLECULAR WEIGHT: 256.3461
SMILES: CC1=CC=CC=C1C2=NC3(CCCCC3)N=C2NN
Structure:
CAS RN: 40631-75-2
CAS Name: 2-[[2,5-bis(chloromethyl)-3,4-dihydroxy-2-oxolanyl]oxy]-6-(chloromethyl)oxane-3,4,5-triol
OPENEYE Name: 2-[2,5-bis(chloromethyl)-3,4-dihydroxy-tetrahydrofuran-2-yl]oxy-6-(chloromethyl)tetrahydropyran-3,4,5-triol
IUPAC Name: 2-[2,5-bis(chloromethyl)-3,4-dihydroxyoxolan-2-yl]oxy-6-(chloromethyl)oxane-3,4,5-triol
SYSTEMATIC NAME: 2-[2,5-bis(chloromethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxy-6-(chloromethyl)oxane-3,4,5-triol
MOLECULAR FORMULA: C12H19Cl3O8
MOLECULAR WEIGHT: 397.63346
SMILES: C(C1C(C(C(C(O1)OC2(C(C(C(O2)CCl)O)O)CCl)O)O)O)Cl
Structure:
CAS RN: 58510-36-4
CAS Name: 2,4,6-trimethylbenzenesulfonic acid [6-[[3,4-dihydroxy-2,5-bis[(2,4,6-trimethylphenyl)sulfonyloxymethyl]-2-oxolanyl]oxy]-3,4,5-trihydroxy-2-oxanyl]methyl ester
OPENEYE Name: [6-[3,4-dihydroxy-2,5-bis[(2,4,6-trimethylphenyl)sulfonyloxymethyl]tetrahydrofuran-2-yl]oxy-3,4,5-trihydroxy-tetrahydropyran-2-yl]methyl 2,4,6-trimethylbenzenesulfonate
IUPAC Name: [6-[3,4-dihydroxy-2,5-bis[(2,4,6-trimethylphenyl)sulfonyloxymethyl]oxolan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 2,4,6-trimethylbenzenesulfonate
SYSTEMATIC NAME: [6-[3,4-bis(oxidanyl)-2,5-bis[(2,4,6-trimethylphenyl)sulfonyloxymethyl]oxolan-2-yl]oxy-3,4,5-tris(oxidanyl)oxan-2-yl]methyl 2,4,6-trimethylbenzenesulfonate
MOLECULAR FORMULA: C39H52O17S3
MOLECULAR WEIGHT: 889.01498
SMILES: CC1=CC(=C(C(=C1)C)S(=O)(=O)OCC2C(C(C(C(O2)OC3(C(C(C(O3)COS(=O)(=O)C4=C(C=C(C=C4C)C)C)O)O)COS(=O)(=O)C5=C(C=C(C=C5C)C)C)O)O)O)C
Structure:
CAS RN: 64369-23-9
CAS Name: 6-ethyl-3-(5-thiadiazolyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
OPENEYE Name: 6-ethyl-3-(thiadiazol-5-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
IUPAC Name: 6-ethyl-3-(thiadiazol-5-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
SYSTEMATIC NAME: 6-ethyl-3-(1,2,3-thiadiazol-5-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
MOLECULAR FORMULA: C7H6N6S2
MOLECULAR WEIGHT: 238.29274
SMILES: CCC1=NN2C(=NN=C2S1)C3=CN=NS3
Structure:
CAS RN: 57653-12-0
CAS Name: 2-selanylidene-1,3-diselenole-4,5-dicarboxylic acid dimethyl ester
OPENEYE Name: dimethyl 2-selenoxo-1,3-diselenole-4,5-dicarboxylate
IUPAC Name: dimethyl 2-selanylidene-1,3-diselenole-4,5-dicarboxylate
SYSTEMATIC NAME: dimethyl 2-selanylidene-1,3-diselenole-4,5-dicarboxylate
MOLECULAR FORMULA: C7H6O4Se3
MOLECULAR WEIGHT: 391.00014
SMILES: COC(=O)C1=C([Se]C(=[Se])[Se]1)C(=O)OC
Structure:
CAS RN: 31146-98-2
CAS Name: 2-amino-6-[[10-[(5-amino-5-carboxypentyl)amino]-1,10-dioxodecyl]amino]hexanoic acid
OPENEYE Name: 2-amino-6-[[10-[(5-amino-5-carboxy-pentyl)amino]-10-oxo-decanoyl]amino]hexanoic acid
IUPAC Name: 2-amino-6-[[10-[(5-amino-5-carboxypentyl)amino]-10-oxodecanoyl]amino]hexanoic acid
SYSTEMATIC NAME: 2-azanyl-6-[[10-[(5-azanyl-6-oxidanyl-6-oxidanylidene-hexyl)amino]-10-oxidanylidene-decanoyl]amino]hexanoic acid
MOLECULAR FORMULA: C22H42N4O6
MOLECULAR WEIGHT: 458.59208
SMILES: C(CCCCC(=O)NCCCCC(C(=O)O)N)CCCC(=O)NCCCCC(C(=O)O)N
Structure:
CAS RN: 59012-43-0
CAS Name: 2-amino-6-(1-oxohexadecylamino)hexanoic acid
OPENEYE Name: 2-amino-6-(hexadecanoylamino)hexanoic acid
IUPAC Name: 2-amino-6-(hexadecanoylamino)hexanoic acid
SYSTEMATIC NAME: 2-azanyl-6-(hexadecanoylamino)hexanoic acid
MOLECULAR FORMULA: C22H44N2O3
MOLECULAR WEIGHT: 384.59636
SMILES: CCCCCCCCCCCCCCCC(=O)NCCCCC(C(=O)O)N
Structure:
CAS RN: 63147-39-7
CAS Name: 2-amino-6-[[5-[[(5-amino-5-carboxypentyl)amino]-oxomethoxy]pentoxy-oxomethyl]amino]hexanoic acid
OPENEYE Name: 2-amino-6-[5-[(5-amino-5-carboxy-pentyl)carbamoyloxy]pentoxycarbonylamino]hexanoic acid
IUPAC Name: 2-amino-6-[5-[(5-amino-5-carboxypentyl)carbamoyloxy]pentoxycarbonylamino]hexanoic acid
SYSTEMATIC NAME: 2-azanyl-6-[5-[(5-azanyl-6-oxidanyl-6-oxidanylidene-hexyl)carbamoyloxy]pentoxycarbonylamino]hexanoic acid
MOLECULAR FORMULA: C19H36N4O8
MOLECULAR WEIGHT: 448.51114
SMILES: C(CCOC(=O)NCCCCC(C(=O)O)N)CCOC(=O)NCCCCC(C(=O)O)N
Structure:
CAS RN: 63755-81-7
CAS Name: 3,4-dihydroxy-2-methyl-3,4-dihydro-2H-benzo[g][1]benzopyran-5,10-dione
OPENEYE Name: 3,4-dihydroxy-2-methyl-3,4-dihydro-2H-benzo[g]chromene-5,10-dione
IUPAC Name: 3,4-dihydroxy-2-methyl-3,4-dihydro-2H-benzo[g]chromene-5,10-dione
SYSTEMATIC NAME: 2-methyl-3,4-bis(oxidanyl)-3,4-dihydro-2H-benzo[g]chromene-5,10-dione
MOLECULAR FORMULA: C14H12O5
MOLECULAR WEIGHT: 260.24208
SMILES: CC1C(C(C2=C(O1)C(=O)C3=CC=CC=C3C2=O)O)O
Structure:
CAS RN: 63813-74-1
CAS Name: 3,4-dihydroxy-2-methyl-3,4-dihydro-2H-benzo[g][1]benzopyran-5,10-dione
OPENEYE Name: 3,4-dihydroxy-2-methyl-3,4-dihydro-2H-benzo[g]chromene-5,10-dione
IUPAC Name: 3,4-dihydroxy-2-methyl-3,4-dihydro-2H-benzo[g]chromene-5,10-dione
SYSTEMATIC NAME: 2-methyl-3,4-bis(oxidanyl)-3,4-dihydro-2H-benzo[g]chromene-5,10-dione
MOLECULAR FORMULA: C14H12O5
MOLECULAR WEIGHT: 260.24208
SMILES: CC1C(C(C2=C(O1)C(=O)C3=CC=CC=C3C2=O)O)O
Structure:
CAS RN: 2269-40-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H24O8S
MOLECULAR WEIGHT: 400.44336
SMILES: CC1=CC2C(CC1)(C3(C(=O)C(C(C34CO4)O2)OS(=O)(=O)C)C)COC(=O)C
Structure:
CAS RN: 2619-59-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H22O5
MOLECULAR WEIGHT: 306.35358
SMILES: CC1=CC2C(CC1)(C3(CC(=O)C(C34CO4)O2)C)COC(=O)C
Structure:
CAS RN: 68266-27-3
CAS Name: 3-[6-(3-hydroxyphenyl)decan-5-yl]phenol
OPENEYE Name: 3-[1-butyl-2-(3-hydroxyphenyl)hexyl]phenol
IUPAC Name: 3-[6-(3-hydroxyphenyl)decan-5-yl]phenol
SYSTEMATIC NAME: 3-[6-(3-hydroxyphenyl)decan-5-yl]phenol
MOLECULAR FORMULA: C22H30O2
MOLECULAR WEIGHT: 326.4724
SMILES: CCCCC(C1=CC(=CC=C1)O)C(CCCC)C2=CC(=CC=C2)O
Structure:
CAS RN: 68266-25-1
CAS Name: 3-[5-(3-hydroxyphenyl)octan-4-yl]phenol
OPENEYE Name: 3-[2-(3-hydroxyphenyl)-1-propyl-pentyl]phenol
IUPAC Name: 3-[5-(3-hydroxyphenyl)octan-4-yl]phenol
SYSTEMATIC NAME: 3-[5-(3-hydroxyphenyl)octan-4-yl]phenol
MOLECULAR FORMULA: C20H26O2
MOLECULAR WEIGHT: 298.41924
SMILES: CCCC(C1=CC(=CC=C1)O)C(CCC)C2=CC(=CC=C2)O
Structure:
CAS RN: 68266-23-9
CAS Name: 3-[3-(3-hydroxyphenyl)butan-2-yl]phenol
OPENEYE Name: 3-[2-(3-hydroxyphenyl)-1-methyl-propyl]phenol
IUPAC Name: 3-[3-(3-hydroxyphenyl)butan-2-yl]phenol
SYSTEMATIC NAME: 3-[3-(3-hydroxyphenyl)butan-2-yl]phenol
MOLECULAR FORMULA: C16H18O2
MOLECULAR WEIGHT: 242.31292
SMILES: CC(C1=CC(=CC=C1)O)C(C)C2=CC(=CC=C2)O
Structure:
CAS RN: 3272-95-5
CAS Name: 3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid (4-chlorophenyl) ester
OPENEYE Name: (4-chlorophenyl) 2-(benzyloxycarbonylamino)-3-phenyl-propanoate
IUPAC Name: (4-chlorophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
SYSTEMATIC NAME: (4-chlorophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
MOLECULAR FORMULA: C23H20ClNO4
MOLECULAR WEIGHT: 409.8622
SMILES: C1=CC=C(C=C1)CC(C(=O)OC2=CC=C(C=C2)Cl)NC(=O)OCC3=CC=CC=C3
Structure:
CAS RN: 91101-10-9
CAS Name: 5-(2-oxo-3-oxolanyl)imidazolidine-2,4-dione
OPENEYE Name: 5-(2-oxotetrahydrofuran-3-yl)imidazolidine-2,4-dione
IUPAC Name: 5-(2-oxooxolan-3-yl)imidazolidine-2,4-dione
SYSTEMATIC NAME: 5-(2-oxidanylideneoxolan-3-yl)imidazolidine-2,4-dione
MOLECULAR FORMULA: C7H8N2O4
MOLECULAR WEIGHT: 184.14942
SMILES: C1COC(=O)C1C2C(=O)NC(=O)N2
Structure:
CAS RN: 72628-82-1
CAS Name: 2,3-dimethylpyrazino[2,3-f]quinazoline-8,10-diamine
OPENEYE Name: 2,3-dimethylpyrazino[2,3-f]quinazoline-8,10-diamine
IUPAC Name: 2,3-dimethylpyrazino[2,3-f]quinazoline-8,10-diamine
SYSTEMATIC NAME: 2,3-dimethylpyrazino[2,3-f]quinazoline-8,10-diamine
MOLECULAR FORMULA: C12H12N6
MOLECULAR WEIGHT: 240.26388
SMILES: CC1=NC2=C(C3=C(C=C2)N=C(N=C3N)N)N=C1C
Structure:
CAS RN: 68774-89-0
CAS Name: 7-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-one
OPENEYE Name: 7-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-one
IUPAC Name: 7-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-one
SYSTEMATIC NAME: 7-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-one
MOLECULAR FORMULA: C6H6N4O
MOLECULAR WEIGHT: 150.13804
SMILES: CN1C=CN2C=NN=C2C1=O
Structure:
CAS RN: 68774-90-3
CAS Name: 3,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrazin-8-one
OPENEYE Name: 3,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrazin-8-one
IUPAC Name: 3,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrazin-8-one
SYSTEMATIC NAME: 3,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrazin-8-one
MOLECULAR FORMULA: C7H8N4O
MOLECULAR WEIGHT: 164.16462
SMILES: CC1=NN=C2N1C=CN(C2=O)C
Structure:
CAS RN: 68774-95-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C8H7N5
MOLECULAR WEIGHT: 173.17468
SMILES: CC1=NN=C2N1C=CN3C2=NC=C3
Structure:
CAS RN: 1063-77-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C28H34O9
MOLECULAR WEIGHT: 514.56416
SMILES: CC(=O)OC1CC(=O)OC(C2C1(C3CCC4(C(OC(=O)C5C4(C3(C(=O)C2)C)O5)C6=COC=C6)C)C)(C)C
Structure:
CAS RN: 58418-25-0
CAS Name: 2-(tert-butylamino)-3,1-benzoxazin-4-one
OPENEYE Name: 2-(tert-butylamino)-3,1-benzoxazin-4-one
IUPAC Name: 2-(tert-butylamino)-3,1-benzoxazin-4-one
SYSTEMATIC NAME: 2-(tert-butylamino)-3,1-benzoxazin-4-one
MOLECULAR FORMULA: C12H14N2O2
MOLECULAR WEIGHT: 218.25176
SMILES: CC(C)(C)NC1=NC2=CC=CC=C2C(=O)O1
Structure:
CAS RN: 58418-20-5
CAS Name: 3-[hydroxy(methyl)amino]-2-indolone
OPENEYE Name: 3-[hydroxy(methyl)amino]indol-2-one
IUPAC Name: 3-[hydroxy(methyl)amino]indol-2-one
SYSTEMATIC NAME: 3-[methyl(oxidanyl)amino]indol-2-one
MOLECULAR FORMULA: C9H8N2O2
MOLECULAR WEIGHT: 176.17202
SMILES: CN(C1=C2C=CC=CC2=NC1=O)O
Structure:
CAS RN: 65427-46-5
CAS Name: N-(2-oxo-5,5-diphenyl-3-oxolanyl)carbamic acid (phenylmethyl) ester
OPENEYE Name: benzyl N-(2-oxo-5,5-diphenyl-tetrahydrofuran-3-yl)carbamate
IUPAC Name: benzyl N-(2-oxo-5,5-diphenyloxolan-3-yl)carbamate
SYSTEMATIC NAME: (phenylmethyl) N-(2-oxidanylidene-5,5-diphenyl-oxolan-3-yl)carbamate
MOLECULAR FORMULA: C24H21NO4
MOLECULAR WEIGHT: 387.42784
SMILES: C1C(C(=O)OC1(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4
Structure:
CAS RN: 58178-33-9
CAS Name: N-(2-oxo-5,5-diphenyl-3-oxolanyl)benzamide
OPENEYE Name: N-(2-oxo-5,5-diphenyl-tetrahydrofuran-3-yl)benzamide
IUPAC Name: N-(2-oxo-5,5-diphenyloxolan-3-yl)benzamide
SYSTEMATIC NAME: N-(2-oxidanylidene-5,5-diphenyl-oxolan-3-yl)benzamide
MOLECULAR FORMULA: C23H19NO3
MOLECULAR WEIGHT: 357.40186
SMILES: C1C(C(=O)OC1(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4
Structure:
CAS RN: 63777-09-3
CAS Name: 4,4-dimethyl-1,3-diphenyl-6-propan-2-yloxy-5,6-dihydropyrano[2,3-c]pyrazole
OPENEYE Name: 6-isopropoxy-4,4-dimethyl-1,3-diphenyl-5,6-dihydropyrano[2,3-c]pyrazole
IUPAC Name: 4,4-dimethyl-1,3-diphenyl-6-propan-2-yloxy-5,6-dihydropyrano[2,3-c]pyrazole
SYSTEMATIC NAME: 4,4-dimethyl-1,3-diphenyl-6-propan-2-yloxy-5,6-dihydropyrano[2,3-c]pyrazole
MOLECULAR FORMULA: C23H26N2O2
MOLECULAR WEIGHT: 362.46474
SMILES: CC(C)OC1CC(C2=C(O1)N(N=C2C3=CC=CC=C3)C4=CC=CC=C4)(C)C
Structure:
CAS RN: 63777-07-1
CAS Name: 4,4-dimethyl-6-(2-methylpropoxy)-1,3-diphenyl-5,6-dihydropyrano[2,3-c]pyrazole
OPENEYE Name: 6-isobutoxy-4,4-dimethyl-1,3-diphenyl-5,6-dihydropyrano[2,3-c]pyrazole
IUPAC Name: 4,4-dimethyl-6-(2-methylpropoxy)-1,3-diphenyl-5,6-dihydropyrano[2,3-c]pyrazole
SYSTEMATIC NAME: 4,4-dimethyl-6-(2-methylpropoxy)-1,3-diphenyl-5,6-dihydropyrano[2,3-c]pyrazole
MOLECULAR FORMULA: C24H28N2O2
MOLECULAR WEIGHT: 376.49132
SMILES: CC(C)COC1CC(C2=C(O1)N(N=C2C3=CC=CC=C3)C4=CC=CC=C4)(C)C
Structure:
CAS RN: 63777-05-9
CAS Name: 6-ethoxy-4,4-dimethyl-1,3-diphenyl-5,6-dihydropyrano[2,3-c]pyrazole
OPENEYE Name: 6-ethoxy-4,4-dimethyl-1,3-diphenyl-5,6-dihydropyrano[2,3-c]pyrazole
IUPAC Name: 6-ethoxy-4,4-dimethyl-1,3-diphenyl-5,6-dihydropyrano[2,3-c]pyrazole
SYSTEMATIC NAME: 6-ethoxy-4,4-dimethyl-1,3-diphenyl-5,6-dihydropyrano[2,3-c]pyrazole
MOLECULAR FORMULA: C22H24N2O2
MOLECULAR WEIGHT: 348.43816
SMILES: CCOC1CC(C2=C(O1)N(N=C2C3=CC=CC=C3)C4=CC=CC=C4)(C)C
Structure:
CAS RN: 37603-06-8
CAS Name: 8-[(5-methoxy-2,3-dihydrobenzofuran-2-yl)methyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
OPENEYE Name: 8-[(5-methoxy-2,3-dihydrobenzofuran-2-yl)methyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
IUPAC Name: 8-[(5-methoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
SYSTEMATIC NAME: 8-[(5-methoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
MOLECULAR FORMULA: C23H27N3O3
MOLECULAR WEIGHT: 393.47878
SMILES: COC1=CC2=C(C=C1)OC(C2)CN3CCC4(CC3)C(=O)NCN4C5=CC=CC=C5
Structure:
CAS RN: 43083-51-8
CAS Name: 2-amino-3-mercaptobutanoic acid
OPENEYE Name: 2-amino-3-sulfanyl-butanoic acid
IUPAC Name: 2-amino-3-sulfanylbutanoic acid
SYSTEMATIC NAME: 2-azanyl-3-sulfanyl-butanoic acid
MOLECULAR FORMULA: C4H9NO2S
MOLECULAR WEIGHT: 135.18476
SMILES: CC(C(C(=O)O)N)S
Structure:
CAS RN: 62391-08-6
CAS Name: 9-[3-(5-nitro-2-furanyl)prop-2-enylidene]-7,11-dioxaspiro[5.5]undecane-8,10-dione
OPENEYE Name: 9-[3-(5-nitro-2-furyl)prop-2-enylidene]-7,11-dioxaspiro[5.5]undecane-8,10-dione
IUPAC Name: 9-[3-(5-nitrofuran-2-yl)prop-2-enylidene]-7,11-dioxaspiro[5.5]undecane-8,10-dione
SYSTEMATIC NAME: 9-[3-(5-nitrofuran-2-yl)prop-2-enylidene]-7,11-dioxaspiro[5.5]undecane-8,10-dione
MOLECULAR FORMULA: C16H15NO7
MOLECULAR WEIGHT: 333.2928
SMILES: C1CCC2(CC1)OC(=O)C(=CC=CC3=CC=C(O3)[N+](=O)[O-])C(=O)O2
Structure:
CAS RN: 62391-07-5
CAS Name: 8-[3-(5-nitro-2-furanyl)prop-2-enylidene]-6,10-dioxaspiro[4.5]decane-7,9-dione
OPENEYE Name: 8-[3-(5-nitro-2-furyl)prop-2-enylidene]-6,10-dioxaspiro[4.5]decane-7,9-dione
IUPAC Name: 8-[3-(5-nitrofuran-2-yl)prop-2-enylidene]-6,10-dioxaspiro[4.5]decane-7,9-dione
SYSTEMATIC NAME: 8-[3-(5-nitrofuran-2-yl)prop-2-enylidene]-6,10-dioxaspiro[4.5]decane-7,9-dione
MOLECULAR FORMULA: C15H13NO7
MOLECULAR WEIGHT: 319.26622
SMILES: C1CCC2(C1)OC(=O)C(=CC=CC3=CC=C(O3)[N+](=O)[O-])C(=O)O2
Structure:
CAS RN: 62391-06-4
CAS Name: 2-methyl-2-(4-nitrophenyl)-5-[(5-nitro-2-thiophenyl)methylidene]-1,3-dioxane-4,6-dione
OPENEYE Name: 2-methyl-2-(4-nitrophenyl)-5-[(5-nitro-2-thienyl)methylene]-1,3-dioxane-4,6-dione
IUPAC Name: 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione
SYSTEMATIC NAME: 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione
MOLECULAR FORMULA: C16H10N2O8S
MOLECULAR WEIGHT: 390.3242
SMILES: CC1(OC(=O)C(=CC2=CC=C(S2)[N+](=O)[O-])C(=O)O1)C3=CC=C(C=C3)[N+](=O)[O-]
Structure:
CAS RN: 62391-05-3
CAS Name: 2-(4-chlorophenyl)-2-methyl-5-[(5-nitro-2-thiophenyl)methylidene]-1,3-dioxane-4,6-dione
OPENEYE Name: 2-(4-chlorophenyl)-2-methyl-5-[(5-nitro-2-thienyl)methylene]-1,3-dioxane-4,6-dione
IUPAC Name: 2-(4-chlorophenyl)-2-methyl-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione
SYSTEMATIC NAME: 2-(4-chlorophenyl)-2-methyl-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione
MOLECULAR FORMULA: C16H10ClNO6S
MOLECULAR WEIGHT: 379.7717
SMILES: CC1(OC(=O)C(=CC2=CC=C(S2)[N+](=O)[O-])C(=O)O1)C3=CC=C(C=C3)Cl
Structure:
CAS RN: 62391-02-0
CAS Name: 9-[(5-nitro-2-thiophenyl)methylidene]-7,11-dioxaspiro[5.5]undecane-8,10-dione
OPENEYE Name: 9-[(5-nitro-2-thienyl)methylene]-7,11-dioxaspiro[5.5]undecane-8,10-dione
IUPAC Name: 9-[(5-nitrothiophen-2-yl)methylidene]-7,11-dioxaspiro[5.5]undecane-8,10-dione
SYSTEMATIC NAME: 9-[(5-nitrothiophen-2-yl)methylidene]-7,11-dioxaspiro[5.5]undecane-8,10-dione
MOLECULAR FORMULA: C14H13NO6S
MOLECULAR WEIGHT: 323.32112
SMILES: C1CCC2(CC1)OC(=O)C(=CC3=CC=C(S3)[N+](=O)[O-])C(=O)O2
Structure:
CAS RN: 62391-01-9
CAS Name: 8-[(5-nitro-2-thiophenyl)methylidene]-6,10-dioxaspiro[4.5]decane-7,9-dione
OPENEYE Name: 8-[(5-nitro-2-thienyl)methylene]-6,10-dioxaspiro[4.5]decane-7,9-dione
IUPAC Name: 8-[(5-nitrothiophen-2-yl)methylidene]-6,10-dioxaspiro[4.5]decane-7,9-dione
SYSTEMATIC NAME: 8-[(5-nitrothiophen-2-yl)methylidene]-6,10-dioxaspiro[4.5]decane-7,9-dione
MOLECULAR FORMULA: C13H11NO6S
MOLECULAR WEIGHT: 309.29454
SMILES: C1CCC2(C1)OC(=O)C(=CC3=CC=C(S3)[N+](=O)[O-])C(=O)O2
Structure:
CAS RN: 62390-99-2
CAS Name: 2,2-dimethyl-5-[(5-nitro-2-thiophenyl)methylidene]-1,3-dioxane-4,6-dione
OPENEYE Name: 2,2-dimethyl-5-[(5-nitro-2-thienyl)methylene]-1,3-dioxane-4,6-dione
IUPAC Name: 2,2-dimethyl-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione
SYSTEMATIC NAME: 2,2-dimethyl-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione
MOLECULAR FORMULA: C11H9NO6S
MOLECULAR WEIGHT: 283.25726
SMILES: CC1(OC(=O)C(=CC2=CC=C(S2)[N+](=O)[O-])C(=O)O1)C
Structure:
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