CAS RN: 61597-44-2
CAS Name: 2,9-dimethylene-4,7-dioxadispiro[4.0.4^{6}.2^{5}]dodecane-3,8-dione
OPENEYE Name: 2,9-dimethylene-4,7-dioxadispiro[4.0.4^{6}.2^{5}]dodecane-3,8-dione
IUPAC Name: 2,9-dimethylidene-4,7-dioxadispiro[4.0.4^{6}.2^{5}]dodecane-3,8-dione
SYSTEMATIC NAME: 2,9-dimethylidene-4,7-dioxadispiro[4.0.4^{6}.2^{5}]dodecane-3,8-dione
MOLECULAR FORMULA: C12H12O4
MOLECULAR WEIGHT: 220.22128
SMILES: C=C1CC2(CCC23CC(=C)C(=O)O3)OC1=O
Structure:
CAS RN: 62557-53-3
CAS Name: 1-benzoxepin-3,5-dione
OPENEYE Name: 1-benzoxepine-3,5-dione
IUPAC Name: 1-benzoxepine-3,5-dione
SYSTEMATIC NAME: 1-benzoxepine-3,5-dione
MOLECULAR FORMULA: C10H8O3
MOLECULAR WEIGHT: 176.16872
SMILES: C1C(=O)COC2=CC=CC=C2C1=O
Structure:
CAS RN: 1150-29-4
CAS Name: N-(2-cyanoethyl)-2-[(4-methylphenyl)sulfonylamino]acetamide
OPENEYE Name: N-(2-cyanoethyl)-2-(p-tolylsulfonylamino)acetamide
IUPAC Name: N-(2-cyanoethyl)-2-[(4-methylphenyl)sulfonylamino]acetamide
SYSTEMATIC NAME: N-(2-cyanoethyl)-2-[(4-methylphenyl)sulfonylamino]ethanamide
MOLECULAR FORMULA: C12H15N3O3S
MOLECULAR WEIGHT: 281.3308
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)NCCC#N
Structure:
CAS RN: 58484-16-5
CAS Name: 1-(2-chloroethyl)-3-(2,6-dihydroxycyclohexyl)urea
OPENEYE Name: 1-(2-chloroethyl)-3-(2,6-dihydroxycyclohexyl)urea
IUPAC Name: 1-(2-chloroethyl)-3-(2,6-dihydroxycyclohexyl)urea
SYSTEMATIC NAME: 1-[2,6-bis(oxidanyl)cyclohexyl]-3-(2-chloroethyl)urea
MOLECULAR FORMULA: C9H17ClN2O3
MOLECULAR WEIGHT: 236.69588
SMILES: C1CC(C(C(C1)O)NC(=O)NCCCl)O
Structure:
CAS RN: 38150-01-5
CAS Name: 2-nitrocyclohexane-1,3-diol
OPENEYE Name: 2-nitrocyclohexane-1,3-diol
IUPAC Name: 2-nitrocyclohexane-1,3-diol
SYSTEMATIC NAME: 2-nitrocyclohexane-1,3-diol
MOLECULAR FORMULA: C6H11NO4
MOLECULAR WEIGHT: 161.15584
SMILES: C1CC(C(C(C1)O)[N+](=O)[O-])O
Structure:
CAS RN: 38332-12-6
CAS Name: 2-aminocyclohexane-1,3-diol
OPENEYE Name: 2-aminocyclohexane-1,3-diol
IUPAC Name: 2-aminocyclohexane-1,3-diol
SYSTEMATIC NAME: 2-azanylcyclohexane-1,3-diol
MOLECULAR FORMULA: C6H13NO2
MOLECULAR WEIGHT: 131.17292
SMILES: C1CC(C(C(C1)O)N)O
Structure:
CAS RN: 59886-09-8
CAS Name: thiadiazolo[5,4-d]pyrimidine-5,7-diamine
OPENEYE Name: thiadiazolo[5,4-d]pyrimidine-5,7-diamine
IUPAC Name: thiadiazolo[5,4-d]pyrimidine-5,7-diamine
SYSTEMATIC NAME: [1,2,3]thiadiazolo[5,4-d]pyrimidine-5,7-diamine
MOLECULAR FORMULA: C4H4N6S
MOLECULAR WEIGHT: 168.17976
SMILES: C12=C(N=C(N=C1SN=N2)N)N
Structure:
CAS RN: 62805-44-1
CAS Name: benzoic acid [2,3-dibenzoyloxy-4-(2,4-dioxo-1-pyrimidinyl)cyclopentyl]methyl ester
OPENEYE Name: [2,3-dibenzoyloxy-4-(2,4-dioxopyrimidin-1-yl)cyclopentyl]methyl benzoate
IUPAC Name: [2,3-dibenzoyloxy-4-(2,4-dioxopyrimidin-1-yl)cyclopentyl]methyl benzoate
SYSTEMATIC NAME: [4-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-2,3-bis(phenylcarbonyloxy)cyclopentyl]methyl benzoate
MOLECULAR FORMULA: C31H26N2O8
MOLECULAR WEIGHT: 554.54674
SMILES: C1C(C(C(C1N2C=CC(=O)NC2=O)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)COC(=O)C5=CC=CC=C5
Structure:
CAS RN: 58484-17-6
CAS Name: 1-(2-chloroethyl)-3-[(2R,6S)-2,6-dihydroxycyclohexyl]-1-nitrosourea
OPENEYE Name: 1-(2-chloroethyl)-3-[(2R,6S)-2,6-dihydroxycyclohexyl]-1-nitroso-urea
IUPAC Name: 1-(2-chloroethyl)-3-[(2R,6S)-2,6-dihydroxycyclohexyl]-1-nitrosourea
SYSTEMATIC NAME: 3-[(2R,6S)-2,6-bis(oxidanyl)cyclohexyl]-1-(2-chloroethyl)-1-nitroso-urea
MOLECULAR FORMULA: C9H16ClN3O4
MOLECULAR WEIGHT: 265.69404
SMILES: C1C[C@H](C([C@H](C1)O)NC(=O)N(CCCl)N=O)O
Structure:
CAS RN: 78795-27-4
CAS Name: 1-[2,3-dihydroxy-4-(hydroxymethyl)cyclopentyl]-5-methylpyrimidine-2,4-dione
OPENEYE Name: 1-[2,3-dihydroxy-4-(hydroxymethyl)cyclopentyl]-5-methyl-pyrimidine-2,4-dione
IUPAC Name: 1-[2,3-dihydroxy-4-(hydroxymethyl)cyclopentyl]-5-methylpyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[4-(hydroxymethyl)-2,3-bis(oxidanyl)cyclopentyl]-5-methyl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C11H16N2O5
MOLECULAR WEIGHT: 256.25514
SMILES: CC1=CN(C(=O)NC1=O)C2CC(C(C2O)O)CO
Structure:
CAS RN: 67189-82-6
CAS Name: thiocyanic acid [1-(3,4,5-trihydroxy-2-oxanyl)-5-indolyl] ester
OPENEYE Name: [1-(3,4,5-trihydroxytetrahydropyran-2-yl)indol-5-yl] thiocyanate
IUPAC Name: [1-(3,4,5-trihydroxyoxan-2-yl)indol-5-yl] thiocyanate
SYSTEMATIC NAME: [1-[3,4,5-tris(oxidanyl)oxan-2-yl]indol-5-yl] thiocyanate
MOLECULAR FORMULA: C14H14N2O4S
MOLECULAR WEIGHT: 306.33696
SMILES: C1C(C(C(C(O1)N2C=CC3=C2C=CC(=C3)SC#N)O)O)O
Structure:
CAS RN: 62908-34-3
CAS Name: 3-pyridinyl-[1-[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]-3-indolyl]methanone
OPENEYE Name: 3-pyridyl-[1-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]indol-3-yl]methanone
IUPAC Name: pyridin-3-yl-[1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]indol-3-yl]methanone
SYSTEMATIC NAME: [1-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]indol-3-yl]-pyridin-3-yl-methanone
MOLECULAR FORMULA: C20H20N2O6
MOLECULAR WEIGHT: 384.3826
SMILES: C1=CC=C2C(=C1)C(=CN2C3C(C(C(C(O3)CO)O)O)O)C(=O)C4=CN=CC=C4
Structure:
CAS RN: 58381-39-8
CAS Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]pyrazole-3,5-dicarboxamide
OPENEYE Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrazole-3,5-dicarboxamide
IUPAC Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrazole-3,5-dicarboxamide
SYSTEMATIC NAME: 1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]pyrazole-3,5-dicarboxamide
MOLECULAR FORMULA: C10H14N4O6
MOLECULAR WEIGHT: 286.24136
SMILES: C1=C(N(N=C1C(=O)N)C2C(C(C(O2)CO)O)O)C(=O)N
Structure:
CAS RN: 61241-11-0
CAS Name: 4-amino-2-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-3-pyrazolecarboxamide
OPENEYE Name: 4-amino-2-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrazole-3-carboxamide
IUPAC Name: 4-amino-2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrazole-3-carboxamide
SYSTEMATIC NAME: 4-azanyl-2-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]pyrazole-3-carboxamide
MOLECULAR FORMULA: C9H14N4O5
MOLECULAR WEIGHT: 258.23126
SMILES: C1=NN(C(=C1N)C(=O)N)C2C(C(C(O2)CO)O)O
Structure:
CAS RN: 69259-10-5
CAS Name: 2-(hydroxymethyl)-5-[4-(methylthio)-2-pyrazolo[3,4-d]pyrimidinyl]oxolane-3,4-diol
OPENEYE Name: 2-(hydroxymethyl)-5-(4-methylsulfanylpyrazolo[3,4-d]pyrimidin-2-yl)tetrahydrofuran-3,4-diol
IUPAC Name: 2-(hydroxymethyl)-5-(4-methylsulfanylpyrazolo[3,4-d]pyrimidin-2-yl)oxolane-3,4-diol
SYSTEMATIC NAME: 2-(hydroxymethyl)-5-(4-methylsulfanylpyrazolo[3,4-d]pyrimidin-2-yl)oxolane-3,4-diol
MOLECULAR FORMULA: C11H14N4O4S
MOLECULAR WEIGHT: 298.31826
SMILES: CSC1=NC=NC2=NN(C=C21)C3C(C(C(O3)CO)O)O
Structure:
CAS RN: 67221-52-7
CAS Name: 2-(hydroxymethyl)-5-[7-(methylthio)-1-pyrazolo[4,3-d]pyrimidinyl]oxolane-3,4-diol
OPENEYE Name: 2-(hydroxymethyl)-5-(7-methylsulfanylpyrazolo[4,3-d]pyrimidin-1-yl)tetrahydrofuran-3,4-diol
IUPAC Name: 2-(hydroxymethyl)-5-(7-methylsulfanylpyrazolo[4,3-d]pyrimidin-1-yl)oxolane-3,4-diol
SYSTEMATIC NAME: 2-(hydroxymethyl)-5-(7-methylsulfanylpyrazolo[4,3-d]pyrimidin-1-yl)oxolane-3,4-diol
MOLECULAR FORMULA: C11H14N4O4S
MOLECULAR WEIGHT: 298.31826
SMILES: CSC1=NC=NC2=C1N(N=C2)C3C(C(C(O3)CO)O)O
Structure:
CAS RN: 60355-64-8
CAS Name: 2-(hydroxymethyl)-5-[7-(methylthio)-2-pyrazolo[4,3-d]pyrimidinyl]oxolane-3,4-diol
OPENEYE Name: 2-(hydroxymethyl)-5-(7-methylsulfanylpyrazolo[4,3-d]pyrimidin-2-yl)tetrahydrofuran-3,4-diol
IUPAC Name: 2-(hydroxymethyl)-5-(7-methylsulfanylpyrazolo[4,3-d]pyrimidin-2-yl)oxolane-3,4-diol
SYSTEMATIC NAME: 2-(hydroxymethyl)-5-(7-methylsulfanylpyrazolo[4,3-d]pyrimidin-2-yl)oxolane-3,4-diol
MOLECULAR FORMULA: C11H14N4O4S
MOLECULAR WEIGHT: 298.31826
SMILES: CSC1=NC=NC2=CN(N=C21)C3C(C(C(O3)CO)O)O
Structure:
CAS RN: 24338-53-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H22O7
MOLECULAR WEIGHT: 362.37378
SMILES: CC(C)C1=C2C(C3C4C(C(C5C(C4(C2=CC(=O)O1)C)O5)O)(C(=O)O3)C)O
Structure:
CAS RN: 89033-55-6
CAS Name: 4,6-diamino-5-nitroso-1H-pyrimidin-2-one
OPENEYE Name: 4,6-diamino-5-nitroso-1H-pyrimidin-2-one
IUPAC Name: 4,6-diamino-5-nitroso-1H-pyrimidin-2-one
SYSTEMATIC NAME: 4,6-bis(azanyl)-5-nitroso-1H-pyrimidin-2-one
MOLECULAR FORMULA: C4H5N5O2
MOLECULAR WEIGHT: 155.1148
SMILES: C1(=C(NC(=O)N=C1N)N)N=O
Structure:
CAS RN: 59851-49-9
CAS Name: 5-amino-2,6-dioxo-1,3-diazinane-4-carboxylic acid
OPENEYE Name: 5-amino-2,6-dioxo-hexahydropyrimidine-4-carboxylic acid
IUPAC Name: 5-amino-2,6-dioxo-1,3-diazinane-4-carboxylic acid
SYSTEMATIC NAME: 5-azanyl-2,6-bis(oxidanylidene)-1,3-diazinane-4-carboxylic acid
MOLECULAR FORMULA: C5H7N3O4
MOLECULAR WEIGHT: 173.12678
SMILES: C1(C(NC(=O)NC1=O)C(=O)O)N
Structure:
CAS RN: 68381-76-0
CAS Name: methanesulfonic acid [3-[2-(4-chloro-3,5-dimethylphenoxy)ethylsulfonyl]-4-methylsulfonyloxybutyl] ester
OPENEYE Name: [3-[2-(4-chloro-3,5-dimethyl-phenoxy)ethylsulfonyl]-4-methylsulfonyloxy-butyl] methanesulfonate
IUPAC Name: [3-[2-(4-chloro-3,5-dimethylphenoxy)ethylsulfonyl]-4-methylsulfonyloxybutyl] methanesulfonate
SYSTEMATIC NAME: [3-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethylsulfonyl]-4-methylsulfonyloxy-butyl] methanesulfonate
MOLECULAR FORMULA: C16H25ClO9S3
MOLECULAR WEIGHT: 493.0123
SMILES: CC1=CC(=CC(=C1Cl)C)OCCS(=O)(=O)C(CCOS(=O)(=O)C)COS(=O)(=O)C
Structure:
CAS RN: 62375-34-2
CAS Name: 2,5,6-trimethylbenzotriazole-4,7-dione
OPENEYE Name: 2,5,6-trimethylbenzotriazole-4,7-dione
IUPAC Name: 2,5,6-trimethylbenzotriazole-4,7-dione
SYSTEMATIC NAME: 2,5,6-trimethylbenzotriazole-4,7-dione
MOLECULAR FORMULA: C9H9N3O2
MOLECULAR WEIGHT: 191.18666
SMILES: CC1=C(C(=O)C2=NN(N=C2C1=O)C)C
Structure:
CAS RN: 67965-13-3
CAS Name: acetic acid [2-acetyloxy-6-(hydroxymethyl)-4,5-bis(phenylmethoxy)-3-oxanyl] ester
OPENEYE Name: [2-acetoxy-4,5-dibenzyloxy-6-(hydroxymethyl)tetrahydropyran-3-yl] acetate
IUPAC Name: [2-acetyloxy-6-(hydroxymethyl)-4,5-bis(phenylmethoxy)oxan-3-yl] acetate
SYSTEMATIC NAME: [2-acetyloxy-6-(hydroxymethyl)-4,5-bis(phenylmethoxy)oxan-3-yl] ethanoate
MOLECULAR FORMULA: C24H28O8
MOLECULAR WEIGHT: 444.47432
SMILES: CC(=O)OC1C(C(C(OC1OC(=O)C)CO)OCC2=CC=CC=C2)OCC3=CC=CC=C3
Structure:
CAS RN: 2799-12-4
CAS Name: 4-amino-4-oxo-3-(phenylmethoxycarbonylamino)butanoic acid
OPENEYE Name: 4-amino-3-(benzyloxycarbonylamino)-4-oxo-butanoic acid
IUPAC Name: 4-amino-4-oxo-3-(phenylmethoxycarbonylamino)butanoic acid
SYSTEMATIC NAME: 4-azanyl-4-oxidanylidene-3-(phenylmethoxycarbonylamino)butanoic acid
MOLECULAR FORMULA: C12H14N2O5
MOLECULAR WEIGHT: 266.24996
SMILES: C1=CC=C(C=C1)COC(=O)NC(CC(=O)O)C(=O)N
Structure:
CAS RN: 64949-91-3
CAS Name: 2-[[[2-(2-benzamidoethyl)-4-thiazolyl]-oxomethyl]amino]-3-[(triphenylmethyl)thio]propanoic acid ethyl ester
OPENEYE Name: ethyl 2-[[2-(2-benzamidoethyl)thiazole-4-carbonyl]amino]-3-tritylsulfanyl-propanoate
IUPAC Name: ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazole-4-carbonyl]amino]-3-tritylsulfanylpropanoate
SYSTEMATIC NAME: ethyl 2-[[2-(2-benzamidoethyl)-1,3-thiazol-4-yl]carbonylamino]-3-(triphenylmethyl)sulfanyl-propanoate
MOLECULAR FORMULA: C37H35N3O4S2
MOLECULAR WEIGHT: 649.8215
SMILES: CCOC(=O)C(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C4=CSC(=N4)CCNC(=O)C5=CC=CC=C5
Structure:
CAS RN: 64377-83-9
CAS Name: N-methyl-N-[[5-oxo-5-(propan-2-ylamino)pentyl]-phenylmethoxycarbonylamino]carbamic acid (phenylmethyl) ester
OPENEYE Name: benzyl N-[benzyloxycarbonyl-[5-(isopropylamino)-5-oxo-pentyl]amino]-N-methyl-carbamate
IUPAC Name: benzyl N-methyl-N-[[5-oxo-5-(propan-2-ylamino)pentyl]-phenylmethoxycarbonylamino]carbamate
SYSTEMATIC NAME: (phenylmethyl) N-methyl-N-[[5-oxidanylidene-5-(propan-2-ylamino)pentyl]-phenylmethoxycarbonyl-amino]carbamate
MOLECULAR FORMULA: C25H33N3O5
MOLECULAR WEIGHT: 455.54662
SMILES: CC(C)NC(=O)CCCCN(C(=O)OCC1=CC=CC=C1)N(C)C(=O)OCC2=CC=CC=C2
Structure:
CAS RN: 64377-82-8
CAS Name: N-methyl-N-[[4-oxo-4-(propan-2-ylamino)butyl]-phenylmethoxycarbonylamino]carbamic acid (phenylmethyl) ester
OPENEYE Name: benzyl N-[benzyloxycarbonyl-[4-(isopropylamino)-4-oxo-butyl]amino]-N-methyl-carbamate
IUPAC Name: benzyl N-methyl-N-[[4-oxo-4-(propan-2-ylamino)butyl]-phenylmethoxycarbonylamino]carbamate
SYSTEMATIC NAME: (phenylmethyl) N-methyl-N-[[4-oxidanylidene-4-(propan-2-ylamino)butyl]-phenylmethoxycarbonyl-amino]carbamate
MOLECULAR FORMULA: C24H31N3O5
MOLECULAR WEIGHT: 441.52004
SMILES: CC(C)NC(=O)CCCN(C(=O)OCC1=CC=CC=C1)N(C)C(=O)OCC2=CC=CC=C2
Structure:
CAS RN: 64377-79-3
CAS Name: 3-[[methyl(phenylmethoxycarbonyl)amino]-phenylmethoxycarbonylamino]propanoic acid ethyl ester
OPENEYE Name: ethyl 3-[benzyloxycarbonyl-[benzyloxycarbonyl(methyl)amino]amino]propanoate
IUPAC Name: ethyl 3-[[methyl(phenylmethoxycarbonyl)amino]-phenylmethoxycarbonylamino]propanoate
SYSTEMATIC NAME: ethyl 3-[[methyl(phenylmethoxycarbonyl)amino]-phenylmethoxycarbonyl-amino]propanoate
MOLECULAR FORMULA: C22H26N2O6
MOLECULAR WEIGHT: 414.45164
SMILES: CCOC(=O)CCN(C(=O)OCC1=CC=CC=C1)N(C)C(=O)OCC2=CC=CC=C2
Structure:
CAS RN: 65370-90-3
CAS Name: 4-amino-1-[6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-1,3,5-triazin-2-one
OPENEYE Name: 4-amino-1-[6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-1,3,5-triazin-2-one
IUPAC Name: 4-amino-1-[6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-1,3,5-triazin-2-one
SYSTEMATIC NAME: 4-azanyl-1-[6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-1,3,5-triazin-2-one
MOLECULAR FORMULA: C11H16N4O5
MOLECULAR WEIGHT: 284.26854
SMILES: CC1(OC2C(OC(C2O1)N3C=NC(=NC3=O)N)CO)C
Structure:
CAS RN: 13272-36-1
CAS Name: 2-[2-(1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)ethyl]-2,4-diazaspiro[4.5]decane-1,3-dione
OPENEYE Name: 2-[2-(1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)ethyl]-2,4-diazaspiro[4.5]decane-1,3-dione
IUPAC Name: 2-[2-(1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)ethyl]-2,4-diazaspiro[4.5]decane-1,3-dione
SYSTEMATIC NAME: 2-[2-[1,3-bis(oxidanylidene)-2,4-diazaspiro[4.5]decan-2-yl]ethyl]-2,4-diazaspiro[4.5]decane-1,3-dione
MOLECULAR FORMULA: C18H26N4O4
MOLECULAR WEIGHT: 362.42344
SMILES: C1CCC2(CC1)C(=O)N(C(=O)N2)CCN3C(=O)C4(CCCCC4)NC3=O
Structure:
CAS RN: 70609-59-5
CAS Name: N-[6-[[(1S,3S)-3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-3-hydroxy-2-methyl-4-oxanyl]-4-pyridinecarboxamide
OPENEYE Name: N-[6-[[(1S,3S)-3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-3-hydroxy-2-methyl-tetrahydropyran-4-yl]pyridine-4-carboxamide
IUPAC Name: N-[6-[[(1S,3S)-3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-3-hydroxy-2-methyloxan-4-yl]pyridine-4-carboxamide
SYSTEMATIC NAME: N-[6-[[(1S,3S)-3-ethanoyl-10-methoxy-3,5,12-tris(oxidanyl)-6,11-bis(oxidanylidene)-2,4-dihydro-1H-tetracen-1-yl]oxy]-2-methyl-3-oxidanyl-oxan-4-yl]pyridine-4-carboxamide
MOLECULAR FORMULA: C33H32N2O11
MOLECULAR WEIGHT: 632.61398
SMILES: CC1C(C(CC(O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)C)O)NC(=O)C6=CC=NC=C6)O
Structure:
CAS RN: 61948-33-2
CAS Name: 4-(3,4-dimethoxy-2-phenylmethoxyphenyl)-5,6-dimethyl-3-pyridinecarbonitrile
OPENEYE Name: 4-(2-benzyloxy-3,4-dimethoxy-phenyl)-5,6-dimethyl-pyridine-3-carbonitrile
IUPAC Name: 4-(3,4-dimethoxy-2-phenylmethoxyphenyl)-5,6-dimethylpyridine-3-carbonitrile
SYSTEMATIC NAME: 4-(3,4-dimethoxy-2-phenylmethoxy-phenyl)-5,6-dimethyl-pyridine-3-carbonitrile
MOLECULAR FORMULA: C23H22N2O3
MOLECULAR WEIGHT: 374.43238
SMILES: CC1=C(C(=CN=C1C)C#N)C2=C(C(=C(C=C2)OC)OC)OCC3=CC=CC=C3
Structure:
CAS RN: 37496-77-8
CAS Name: (5-chloro-2-nitrosophenyl)-phenylmethanone
OPENEYE Name: (5-chloro-2-nitroso-phenyl)-phenyl-methanone
IUPAC Name: (5-chloro-2-nitrosophenyl)-phenylmethanone
SYSTEMATIC NAME: (5-chloranyl-2-nitroso-phenyl)-phenyl-methanone
MOLECULAR FORMULA: C13H8ClNO2
MOLECULAR WEIGHT: 245.66112
SMILES: C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)N=O
Structure:
CAS RN: 16860-34-7
CAS Name: 2-phenyl-3-pyrazolidinone
OPENEYE Name: 2-phenylpyrazolidin-3-one
IUPAC Name: 2-phenylpyrazolidin-3-one
SYSTEMATIC NAME: 2-phenylpyrazolidin-3-one
MOLECULAR FORMULA: C9H10N2O
MOLECULAR WEIGHT: 162.1885
SMILES: C1CNN(C1=O)C2=CC=CC=C2
Structure:
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