Tuesday, June 26, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 4-(benzenesulfinyl)-6,6-bis(4-fluorophenyl)-3-methyl-dioxan-3-ol
CAS Name: 4-(benzenesulfinyl)-6,6-bis(4-fluorophenyl)-3-methyl-3-dioxanol
IUPAC NAME: 4-(benzenesulfinyl)-6,6-bis(4-fluorophenyl)-3-methyldioxan-3-ol
SYSTEMATIC NAME: 6,6-bis(4-fluorophenyl)-3-methyl-4-(phenylsulfinyl)-1,2-dioxan-3-ol
MOLECULAR FORMULA: C23H20F2O4S
MOLECULAR WEIGHT: 430.464306
SMILES: CC1(C(CC(OO1)(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)S(=O)C4=CC=CC=C4)O
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Product OPENEYE NAME: 4-(benzenesulfinyl)-6,6-bis(4-methoxyphenyl)-3-methyl-dioxan-3-ol
CAS Name: 4-(benzenesulfinyl)-6,6-bis(4-methoxyphenyl)-3-methyl-3-dioxanol
IUPAC NAME: 4-(benzenesulfinyl)-6,6-bis(4-methoxyphenyl)-3-methyldioxan-3-ol
SYSTEMATIC NAME: 6,6-bis(4-methoxyphenyl)-3-methyl-4-(phenylsulfinyl)-1,2-dioxan-3-ol
MOLECULAR FORMULA: C25H26O6S
MOLECULAR WEIGHT: 454.53534
SMILES: CC1(C(CC(OO1)(C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)S(=O)C4=CC=CC=C4)O
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Product OPENEYE NAME: 4-(benzenesulfinyl)-6,6-diethyl-3-methyl-dioxan-3-ol
CAS Name: 4-(benzenesulfinyl)-6,6-diethyl-3-methyl-3-dioxanol
IUPAC NAME: 4-(benzenesulfinyl)-6,6-diethyl-3-methyldioxan-3-ol
SYSTEMATIC NAME: 6,6-diethyl-3-methyl-4-(phenylsulfinyl)-1,2-dioxan-3-ol
MOLECULAR FORMULA: C15H22O4S
MOLECULAR WEIGHT: 298.39778
SMILES: CCC1(CC(C(OO1)(C)O)S(=O)C2=CC=CC=C2)CC
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Product OPENEYE NAME: 4-(benzenesulfonyl)-3-methyl-6,6-diphenyl-dioxan-3-ol
CAS Name: 4-(benzenesulfonyl)-3-methyl-6,6-diphenyl-3-dioxanol
IUPAC NAME: 4-(benzenesulfonyl)-3-methyl-6,6-diphenyldioxan-3-ol
SYSTEMATIC NAME: 3-methyl-6,6-diphenyl-4-(phenylsulfonyl)-1,2-dioxan-3-ol
MOLECULAR FORMULA: C23H22O5S
MOLECULAR WEIGHT: 410.48278
SMILES: CC1(C(CC(OO1)(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)O
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Product OPENEYE NAME: 4-(benzenesulfonyl)-6,6-bis(4-chlorophenyl)-3-methyl-dioxan-3-ol
CAS Name: 4-(benzenesulfonyl)-6,6-bis(4-chlorophenyl)-3-methyl-3-dioxanol
IUPAC NAME: 4-(benzenesulfonyl)-6,6-bis(4-chlorophenyl)-3-methyldioxan-3-ol
SYSTEMATIC NAME: 6,6-bis(4-chlorophenyl)-3-methyl-4-(phenylsulfonyl)-1,2-dioxan-3-ol
MOLECULAR FORMULA: C23H20Cl2O5S
MOLECULAR WEIGHT: 479.3729
SMILES: CC1(C(CC(OO1)(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=CC=C4)O
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Product OPENEYE NAME: 4-(benzenesulfonyl)-3-methyl-6,6-bis(p-tolyl)dioxan-3-ol
CAS Name: 4-(benzenesulfonyl)-3-methyl-6,6-bis(4-methylphenyl)-3-dioxanol
IUPAC NAME: 4-(benzenesulfonyl)-3-methyl-6,6-bis(4-methylphenyl)dioxan-3-ol
SYSTEMATIC NAME: 3-methyl-6,6-bis(4-methylphenyl)-4-(phenylsulfonyl)-1,2-dioxan-3-ol
MOLECULAR FORMULA: C25H26O5S
MOLECULAR WEIGHT: 438.53594
SMILES: CC1=CC=C(C=C1)C2(CC(C(OO2)(C)O)S(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C
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Product OPENEYE NAME: 3-methyl-6,6-diphenyl-4-(p-tolylsulfonyl)dioxan-3-ol
CAS Name: 3-methyl-4-(4-methylphenyl)sulfonyl-6,6-diphenyl-3-dioxanol
IUPAC NAME: 3-methyl-4-(4-methylphenyl)sulfonyl-6,6-diphenyldioxan-3-ol
SYSTEMATIC NAME: 3-methyl-4-(4-methylphenyl)sulfonyl-6,6-diphenyl-1,2-dioxan-3-ol
MOLECULAR FORMULA: C24H24O5S
MOLECULAR WEIGHT: 424.50936
SMILES: CC1=CC=C(C=C1)S(=O)(=O)C2CC(OOC2(C)O)(C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: 4-dimethoxyphosphoryl-3-methyl-6,6-diphenyl-dioxan-3-ol
CAS Name: 4-dimethoxyphosphoryl-3-methyl-6,6-diphenyl-3-dioxanol
IUPAC NAME: 4-dimethoxyphosphoryl-3-methyl-6,6-diphenyldioxan-3-ol
SYSTEMATIC NAME: 4-dimethoxyphosphoryl-3-methyl-6,6-diphenyl-1,2-dioxan-3-ol
MOLECULAR FORMULA: C19H23O6P
MOLECULAR WEIGHT: 378.356081
SMILES: CC1(C(CC(OO1)(C2=CC=CC=C2)C3=CC=CC=C3)P(=O)(OC)OC)O
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Product OPENEYE NAME: 4-(benzenesulfinyl)-2,2-bis(4-chlorophenyl)-5-methyl-3H-furan
CAS Name: 4-(benzenesulfinyl)-2,2-bis(4-chlorophenyl)-5-methyl-3H-furan
IUPAC NAME: 4-(benzenesulfinyl)-2,2-bis(4-chlorophenyl)-5-methyl-3H-furan
SYSTEMATIC NAME: 2,2-bis(4-chlorophenyl)-5-methyl-4-(phenylsulfinyl)-3H-furan
MOLECULAR FORMULA: C23H18Cl2O2S
MOLECULAR WEIGHT: 429.35882
SMILES: CC1=C(CC(O1)(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)S(=O)C4=CC=CC=C4
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Product OPENEYE NAME: 8a-hydroxy-3,3-diphenyl-4a,8-dihydro-4H-thiopyrano[3,4-c][1,2]dioxin-5-one
CAS Name: 8a-hydroxy-3,3-diphenyl-4a,8-dihydro-4H-thiopyrano[3,4-c][1,2]dioxin-5-one
IUPAC NAME: 8a-hydroxy-3,3-diphenyl-4a,8-dihydro-4H-thiopyrano[3,4-c][1,2]dioxin-5-one
SYSTEMATIC NAME: 8a-oxidanyl-3,3-diphenyl-4a,8-dihydro-4H-thiopyrano[3,4-c][1,2]dioxin-5-one
MOLECULAR FORMULA: C19H18O4S
MOLECULAR WEIGHT: 342.40882
SMILES: C1C2C(=O)CSCC2(OOC1(C3=CC=CC=C3)C4=CC=CC=C4)O
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C97H84N8O8S8-2
MOLECULAR WEIGHT: 1746.27366
SMILES: CCOC1=C(C(=C(C2=C([N-]C(=C21)C)/N=C\3/C4=C(C(=C(C(=C4OCC)SC5=CC=CC=C5)SC6=CC=CC=C6)OCC)C(=N3)N=C7C8=C(C(=C(C(=C8OCC)SC9=CC=CC=C9)SC1=CC=CC=C1)OCC)C(=NC1=NC(=N)C2=C1C(=C(C(=C2OCC)SC1=CC=CC=C1)SC1=CC=CC=C1)OCC)[N-]7)OCC)SC1=CC=CC=C1)SC1=CC=CC=C1
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MOLECULAR FORMULA: C97H86N8O8S8
MOLECULAR WEIGHT: 1748.28954
SMILES: CCOC1=C(C(=C(C2=C(NC(=C21)C)/N=C\3/C4=C(C(=C(C(=C4OCC)SC5=CC=CC=C5)SC6=CC=CC=C6)OCC)C(=N3)N=C7C8=C(C(=C(C(=C8OCC)SC9=CC=CC=C9)SC1=CC=CC=C1)OCC)C(=NC1=NC(=N)C2=C1C(=C(C(=C2OCC)SC1=CC=CC=C1)SC1=CC=CC=C1)OCC)N7)OCC)SC1=CC=CC=C1)SC1=CC=CC=C1
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MOLECULAR FORMULA: C121H132N8O8S8-2
MOLECULAR WEIGHT: 2082.91158
SMILES: CCCCCOC1=C(C(=C(C2=C([N-]C(=C21)C)/N=C\3/C4=C(C(=C(C(=C4OCCCCC)SC5=CC=CC=C5)SC6=CC=CC=C6)OCCCCC)C(=N3)N=C7C8=C(C(=C(C(=C8OCCCCC)SC9=CC=CC=C9)SC1=CC=CC=C1)OCCCCC)C(=NC1=NC(=N)C2=C1C(=C(C(=C2OCCCCC)SC1=CC=CC=C1)SC1=CC=CC=C1)OCCCCC)[N-]7)OCCCCC)SC1=CC=CC=C1)
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MOLECULAR FORMULA: C121H134N8O8S8
MOLECULAR WEIGHT: 2084.92746
SMILES: CCCCCOC1=C(C(=C(C2=C(NC(=C21)C)/N=C\3/C4=C(C(=C(C(=C4OCCCCC)SC5=CC=CC=C5)SC6=CC=CC=C6)OCCCCC)C(=N3)N=C7C8=C(C(=C(C(=C8OCCCCC)SC9=CC=CC=C9)SC1=CC=CC=C1)OCCCCC)C(=NC1=NC(=N)C2=C1C(=C(C(=C2OCCCCC)SC1=CC=CC=C1)SC1=CC=CC=C1)OCCCCC)N7)OCCCCC)SC1=CC=CC=C1)SC1=CC
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C19H18N4O2
MOLECULAR WEIGHT: 334.37182
SMILES: CC(=O)N1CCC2=C(C3=CC=CC=C31)N=C[N+]4=C2N5CCCC5=C4[O-]
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MOLECULAR FORMULA: C19H19N4O2+
MOLECULAR WEIGHT: 335.37976
SMILES: CC(=O)N1CCC2=C(C3=CC=CC=C31)N=C[N+]4=C2N5CCCC5=C4O
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C20H20N4O2
MOLECULAR WEIGHT: 348.3984
SMILES: CC(=O)N1CCC2=C(C3=CC=CC=C31)N=C[N+]4=C2N5CCCCC5=C4[O-]
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C20H21N4O2+
MOLECULAR WEIGHT: 349.40634
SMILES: CC(=O)N1CCC2=C(C3=CC=CC=C31)N=C[N+]4=C2N5CCCCC5=C4O
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