CAS RN: 30777-94-7
CAS Name: 2-[[4-[(1,3-dioxo-2-isoindolyl)oxymethyl]phenyl]methoxy]isoindole-1,3-dione
OPENEYE Name: 2-[[4-[(1,3-dioxoisoindolin-2-yl)oxymethyl]phenyl]methoxy]isoindoline-1,3-dione
IUPAC Name: 2-[[4-[(1,3-dioxoisoindol-2-yl)oxymethyl]phenyl]methoxy]isoindole-1,3-dione
SYSTEMATIC NAME: 2-[[4-[[1,3-bis(oxidanylidene)isoindol-2-yl]oxymethyl]phenyl]methoxy]isoindole-1,3-dione
MOLECULAR FORMULA: C24H16N2O6
MOLECULAR WEIGHT: 428.39364
SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)OCC3=CC=C(C=C3)CON4C(=O)C5=CC=CC=C5C4=O
Structure:
CAS RN: 91219-68-0
CAS Name: O-(6-aminooxyhexyl)hydroxylamine
OPENEYE Name: O-(6-aminooxyhexyl)hydroxylamine
IUPAC Name: O-(6-aminooxyhexyl)hydroxylamine
SYSTEMATIC NAME: O-(6-azanyloxyhexyl)hydroxylamine
MOLECULAR FORMULA: C6H16N2O2
MOLECULAR WEIGHT: 148.20344
SMILES: C(CCCON)CCON
Structure:
CAS RN: 58634-59-6
CAS Name: 3-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-4,6-bis(phenylmethoxyamino)-4,5-dihydropyrimidin-2-one
OPENEYE Name: 4,6-bis(benzyloxyamino)-3-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4,5-dihydropyrimidin-2-one
IUPAC Name: 3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,6-bis(phenylmethoxyamino)-4,5-dihydropyrimidin-2-one
SYSTEMATIC NAME: 3-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-4,6-bis(phenylmethoxyamino)-4,5-dihydropyrimidin-2-one
MOLECULAR FORMULA: C23H28N4O7
MOLECULAR WEIGHT: 472.49102
SMILES: C1C(N(C(=O)N=C1NOCC2=CC=CC=C2)C3C(C(C(O3)CO)O)O)NOCC4=CC=CC=C4
Structure:
CAS RN: 58634-57-4
CAS Name: 4,6-bis[(4-methoxyphenyl)methoxyamino]-5,6-dihydro-1H-pyrimidin-2-one
OPENEYE Name: 4,6-bis[(4-methoxyphenyl)methoxyamino]-5,6-dihydro-1H-pyrimidin-2-one
IUPAC Name: 4,6-bis[(4-methoxyphenyl)methoxyamino]-5,6-dihydro-1H-pyrimidin-2-one
SYSTEMATIC NAME: 4,6-bis[(4-methoxyphenyl)methoxyamino]-5,6-dihydro-1H-pyrimidin-2-one
MOLECULAR FORMULA: C20H24N4O5
MOLECULAR WEIGHT: 400.42836
SMILES: COC1=CC=C(C=C1)CONC2CC(=NC(=O)N2)NOCC3=CC=C(C=C3)OC
Structure:
CAS RN: 58634-55-2
CAS Name: 4,6-bis[(2-chlorophenyl)methoxyamino]-5,6-dihydro-1H-pyrimidin-2-one
OPENEYE Name: 4,6-bis[(2-chlorophenyl)methoxyamino]-5,6-dihydro-1H-pyrimidin-2-one
IUPAC Name: 4,6-bis[(2-chlorophenyl)methoxyamino]-5,6-dihydro-1H-pyrimidin-2-one
SYSTEMATIC NAME: 4,6-bis[(2-chlorophenyl)methoxyamino]-5,6-dihydro-1H-pyrimidin-2-one
MOLECULAR FORMULA: C18H18Cl2N4O3
MOLECULAR WEIGHT: 409.26652
SMILES: C1C(NC(=O)N=C1NOCC2=CC=CC=C2Cl)NOCC3=CC=CC=C3Cl
Structure:
CAS RN: 58634-56-3
CAS Name: 4,6-bis[(4-nitrophenyl)methoxyamino]-5,6-dihydro-1H-pyrimidin-2-one
OPENEYE Name: 4,6-bis[(4-nitrophenyl)methoxyamino]-5,6-dihydro-1H-pyrimidin-2-one
IUPAC Name: 4,6-bis[(4-nitrophenyl)methoxyamino]-5,6-dihydro-1H-pyrimidin-2-one
SYSTEMATIC NAME: 4,6-bis[(4-nitrophenyl)methoxyamino]-5,6-dihydro-1H-pyrimidin-2-one
MOLECULAR FORMULA: C18H18N6O7
MOLECULAR WEIGHT: 430.37152
SMILES: C1C(NC(=O)N=C1NOCC2=CC=C(C=C2)[N+](=O)[O-])NOCC3=CC=C(C=C3)[N+](=O)[O-]
Structure:
CAS RN: 58634-53-0
CAS Name: 4,6-bis(phenylmethoxyamino)-5,6-dihydro-1H-pyrimidin-2-one
OPENEYE Name: 4,6-bis(benzyloxyamino)-5,6-dihydro-1H-pyrimidin-2-one
IUPAC Name: 4,6-bis(phenylmethoxyamino)-5,6-dihydro-1H-pyrimidin-2-one
SYSTEMATIC NAME: 4,6-bis(phenylmethoxyamino)-5,6-dihydro-1H-pyrimidin-2-one
MOLECULAR FORMULA: C18H20N4O3
MOLECULAR WEIGHT: 340.3764
SMILES: C1C(NC(=O)N=C1NOCC2=CC=CC=C2)NOCC3=CC=CC=C3
Structure:
CAS RN: 35433-52-4
CAS Name: 1,3-dichloro-2-propanone oxime
OPENEYE Name: 1,3-dichloropropan-2-one oxime
IUPAC Name: N-(1,3-dichloropropan-2-ylidene)hydroxylamine
SYSTEMATIC NAME: N-[1,3-bis(chloranyl)propan-2-ylidene]hydroxylamine
MOLECULAR FORMULA: C3H5Cl2NO
MOLECULAR WEIGHT: 141.9839
SMILES: C(C(=NO)CCl)Cl
Structure:
CAS RN: 91731-90-7
CAS Name: N-(4-chlorophenyl)-N-(4-chlorophenyl)azoacetamide
OPENEYE Name: N-(4-chlorophenyl)-N-(4-chlorophenyl)azo-acetamide
IUPAC Name: N-(4-chlorophenyl)-N-[(4-chlorophenyl)diazenyl]acetamide
SYSTEMATIC NAME: N-(4-chlorophenyl)-N-[(4-chlorophenyl)diazenyl]ethanamide
MOLECULAR FORMULA: C14H11Cl2N3O
MOLECULAR WEIGHT: 308.16264
SMILES: CC(=O)N(C1=CC=C(C=C1)Cl)N=NC2=CC=C(C=C2)Cl
Structure:
CAS RN: 1671-85-8
CAS Name: 2-[3-(2-pyridinyl)-1H-1,2,4-triazol-5-yl]pyridine
OPENEYE Name: 2-[3-(2-pyridyl)-1H-1,2,4-triazol-5-yl]pyridine
IUPAC Name: 2-(3-pyridin-2-yl-1H-1,2,4-triazol-5-yl)pyridine
SYSTEMATIC NAME: 2-(3-pyridin-2-yl-1H-1,2,4-triazol-5-yl)pyridine
MOLECULAR FORMULA: C12H9N5
MOLECULAR WEIGHT: 223.23336
SMILES: C1=CC=NC(=C1)C2=NC(=NN2)C3=CC=CC=N3
Structure:
CAS RN: 51216-25-2
CAS Name: 1-(4-hydroxy-3-propyl-2-sulfanylidene-5-thiazolyl)-1-propanone
OPENEYE Name: 1-(4-hydroxy-3-propyl-2-thioxo-thiazol-5-yl)propan-1-one
IUPAC Name: 1-(4-hydroxy-3-propyl-2-sulfanylidene-1,3-thiazol-5-yl)propan-1-one
SYSTEMATIC NAME: 1-(4-oxidanyl-3-propyl-2-sulfanylidene-1,3-thiazol-5-yl)propan-1-one
MOLECULAR FORMULA: C9H13NO2S2
MOLECULAR WEIGHT: 231.33502
SMILES: CCCN1C(=C(SC1=S)C(=O)CC)O
Structure:
CAS RN: 15845-88-2
CAS Name: 5-methylindolo[2,3-b]quinoxaline
OPENEYE Name: 5-methylindolo[2,3-b]quinoxaline
IUPAC Name: 5-methylindolo[2,3-b]quinoxaline
SYSTEMATIC NAME: 5-methylindolo[2,3-b]quinoxaline
MOLECULAR FORMULA: C15H11N3
MOLECULAR WEIGHT: 233.26794
SMILES: CN1C2=CC=CC=C2N=C3C1=NC4=CC=CC=C43
Structure:
CAS RN: 13676-06-7
CAS Name: 2-diethoxyphosphoryl-2-ethoxyacetic acid ethyl ester
OPENEYE Name: ethyl 2-diethoxyphosphoryl-2-ethoxy-acetate
IUPAC Name: ethyl 2-diethoxyphosphoryl-2-ethoxyacetate
SYSTEMATIC NAME: ethyl 2-diethoxyphosphoryl-2-ethoxy-ethanoate
MOLECULAR FORMULA: C10H21O6P
MOLECULAR WEIGHT: 268.243901
SMILES: CCOC(C(=O)OCC)P(=O)(OCC)OCC
Structure:
CAS RN: 68375-43-9
CAS Name: N,5-dimethyl-4-nitro-1H-pyrazole-3-carboxamide
OPENEYE Name: N,5-dimethyl-4-nitro-1H-pyrazole-3-carboxamide
IUPAC Name: N,5-dimethyl-4-nitro-1H-pyrazole-3-carboxamide
SYSTEMATIC NAME: N,5-dimethyl-4-nitro-1H-pyrazole-3-carboxamide
MOLECULAR FORMULA: C6H8N4O3
MOLECULAR WEIGHT: 184.15272
SMILES: CC1=C(C(=NN1)C(=O)NC)[N+](=O)[O-]
Structure:
CAS RN: 58048-36-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C11H11IN6O4
MOLECULAR WEIGHT: 418.14731
SMILES: C1=C(C2=C(N1C3C(C(C(O3)CO)O)O)N=CN4C2=NN=N4)I
Structure:
CAS RN: 56957-52-9
CAS Name: 1-[cyclohexyl(methyl)amino]-3,3-dimethyl-2-butanone
OPENEYE Name: 1-[cyclohexyl(methyl)amino]-3,3-dimethyl-butan-2-one
IUPAC Name: 1-[cyclohexyl(methyl)amino]-3,3-dimethylbutan-2-one
SYSTEMATIC NAME: 1-[cyclohexyl(methyl)amino]-3,3-dimethyl-butan-2-one
MOLECULAR FORMULA: C13H25NO
MOLECULAR WEIGHT: 211.3437
SMILES: CC(C)(C)C(=O)CN(C)C1CCCCC1
Structure:
CAS RN: 56957-50-7
CAS Name: 3-methyl-3-(N-methylanilino)-2-butanone
OPENEYE Name: 3-methyl-3-(N-methylanilino)butan-2-one
IUPAC Name: 3-methyl-3-(N-methylanilino)butan-2-one
SYSTEMATIC NAME: 3-methyl-3-[methyl(phenyl)amino]butan-2-one
MOLECULAR FORMULA: C12H17NO
MOLECULAR WEIGHT: 191.26948
SMILES: CC(=O)C(C)(C)N(C)C1=CC=CC=C1
Structure:
CAS RN: 56957-56-3
CAS Name: 1-(dimethylamino)-3,3-dimethyl-2-butanone
OPENEYE Name: 1-(dimethylamino)-3,3-dimethyl-butan-2-one
IUPAC Name: 1-(dimethylamino)-3,3-dimethylbutan-2-one
SYSTEMATIC NAME: 1-(dimethylamino)-3,3-dimethyl-butan-2-one
MOLECULAR FORMULA: C8H17NO
MOLECULAR WEIGHT: 143.22668
SMILES: CC(C)(C)C(=O)CN(C)C
Structure:
CAS RN: 36810-75-0
CAS Name: 3,3-dimethyl-1-(N-methylanilino)-2-butanone
OPENEYE Name: 3,3-dimethyl-1-(N-methylanilino)butan-2-one
IUPAC Name: 3,3-dimethyl-1-(N-methylanilino)butan-2-one
SYSTEMATIC NAME: 3,3-dimethyl-1-[methyl(phenyl)amino]butan-2-one
MOLECULAR FORMULA: C13H19NO
MOLECULAR WEIGHT: 205.29606
SMILES: CC(C)(C)C(=O)CN(C)C1=CC=CC=C1
Structure:
CAS RN: 56957-47-2
CAS Name: 2-(N-methylanilino)-1-phenyl-1-propanone
OPENEYE Name: 2-(N-methylanilino)-1-phenyl-propan-1-one
IUPAC Name: 2-(N-methylanilino)-1-phenylpropan-1-one
SYSTEMATIC NAME: 2-[methyl(phenyl)amino]-1-phenyl-propan-1-one
MOLECULAR FORMULA: C16H17NO
MOLECULAR WEIGHT: 239.31228
SMILES: CC(C(=O)C1=CC=CC=C1)N(C)C2=CC=CC=C2
Structure:
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