Friday, July 6, 2012

http://ChemLookup.com Compounds




CAS RN: 30130-35-9
CAS Name: 1-acetyl-2-pyrrolidinecarboxamide
OPENEYE Name: 1-acetylpyrrolidine-2-carboxamide
IUPAC Name: 1-acetylpyrrolidine-2-carboxamide
SYSTEMATIC NAME: 1-ethanoylpyrrolidine-2-carboxamide
MOLECULAR FORMULA: C7H12N2O2
MOLECULAR WEIGHT: 156.18238
SMILES: CC(=O)N1CCCC1C(=O)N
Structure:

CAS RN: 14996-34-0
CAS Name: N-(3-oxo-4-isoxazolidinyl)acetamide
OPENEYE Name: N-(3-oxoisoxazolidin-4-yl)acetamide
IUPAC Name: N-(3-oxo-1,2-oxazolidin-4-yl)acetamide
SYSTEMATIC NAME: N-(3-oxidanylidene-1,2-oxazolidin-4-yl)ethanamide
MOLECULAR FORMULA: C5H8N2O3
MOLECULAR WEIGHT: 144.12862
SMILES: CC(=O)NC1CONC1=O
Structure:

CAS RN: 14617-67-5
CAS Name: 4-methylbenzenesulfonic acid (4-acetamido-4,5-dihydroisoxazol-3-yl) ester
OPENEYE Name: (4-acetamido-4,5-dihydroisoxazol-3-yl) 4-methylbenzenesulfonate
IUPAC Name: (4-acetamido-4,5-dihydro-1,2-oxazol-3-yl) 4-methylbenzenesulfonate
SYSTEMATIC NAME: (4-acetamido-4,5-dihydro-1,2-oxazol-3-yl) 4-methylbenzenesulfonate
MOLECULAR FORMULA: C12H14N2O5S
MOLECULAR WEIGHT: 298.31496
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OC2=NOCC2NC(=O)C
Structure:

CAS RN: 14617-43-7
CAS Name: N-(3-methoxy-4,5-dihydroisoxazol-4-yl)acetamide
OPENEYE Name: N-(3-methoxy-4,5-dihydroisoxazol-4-yl)acetamide
IUPAC Name: N-(3-methoxy-4,5-dihydro-1,2-oxazol-4-yl)acetamide
SYSTEMATIC NAME: N-(3-methoxy-4,5-dihydro-1,2-oxazol-4-yl)ethanamide
MOLECULAR FORMULA: C6H10N2O3
MOLECULAR WEIGHT: 158.1552
SMILES: CC(=O)NC1CON=C1OC
Structure:

CAS RN: 50605-05-5
CAS Name: acetic acid [4-acetamido-2-(2,2-dimethyl-1,3-dioxolan-4-yl)-5-methoxy-3-oxolanyl] ester
OPENEYE Name: [4-acetamido-2-(2,2-dimethyl-1,3-dioxolan-4-yl)-5-methoxy-tetrahydrofuran-3-yl] acetate
IUPAC Name: [4-acetamido-2-(2,2-dimethyl-1,3-dioxolan-4-yl)-5-methoxyoxolan-3-yl] acetate
SYSTEMATIC NAME: [4-acetamido-2-(2,2-dimethyl-1,3-dioxolan-4-yl)-5-methoxy-oxolan-3-yl] ethanoate
MOLECULAR FORMULA: C14H23NO7
MOLECULAR WEIGHT: 317.33492
SMILES: CC(=O)NC1C(C(OC1OC)C2COC(O2)(C)C)OC(=O)C
Structure:

CAS RN: 50605-10-2
CAS Name: acetic acid (7-acetamido-6-acetyloxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl) ester
OPENEYE Name: (7-acetamido-6-acetoxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl) acetate
IUPAC Name: (7-acetamido-6-acetyloxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl) acetate
SYSTEMATIC NAME: (7-acetamido-6-acetyloxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl) ethanoate
MOLECULAR FORMULA: C15H23NO8
MOLECULAR WEIGHT: 345.34502
SMILES: CC(=O)NC1C(C2C(COC(O2)(C)C)OC1OC(=O)C)OC(=O)C
Structure:

CAS RN: 50605-18-0
CAS Name: acetic acid (7-acetamido-6-acetyloxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl) ester
OPENEYE Name: (7-acetamido-6-acetoxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl) acetate
IUPAC Name: (7-acetamido-6-acetyloxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl) acetate
SYSTEMATIC NAME: (7-acetamido-6-acetyloxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl) ethanoate
MOLECULAR FORMULA: C15H23NO8
MOLECULAR WEIGHT: 345.34502
SMILES: CC(=O)NC1C(C2C(COC(O2)(C)C)OC1OC(=O)C)OC(=O)C
Structure:

CAS RN: 50448-00-5
CAS Name: N-(8-hydroxy-2,2-dimethyl-6-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl)benzamide
OPENEYE Name: N-(6-benzyloxy-8-hydroxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl)benzamide
IUPAC Name: N-(8-hydroxy-2,2-dimethyl-6-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl)benzamide
SYSTEMATIC NAME: N-(2,2-dimethyl-8-oxidanyl-6-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl)benzamide
MOLECULAR FORMULA: C23H27NO6
MOLECULAR WEIGHT: 413.46358
SMILES: CC1(OCC2C(O1)C(C(C(O2)OCC3=CC=CC=C3)NC(=O)C4=CC=CC=C4)O)C
Structure:

CAS RN: 50605-20-4
CAS Name: acetic acid (6,7-diacetyloxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl) ester
OPENEYE Name: (6,7-diacetoxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl) acetate
IUPAC Name: (6,7-diacetyloxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl) acetate
SYSTEMATIC NAME: (6,7-diacetyloxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl) ethanoate
MOLECULAR FORMULA: C15H22O9
MOLECULAR WEIGHT: 346.32978
SMILES: CC(=O)OC1C2C(COC(O2)(C)C)OC(C1OC(=O)C)OC(=O)C
Structure:

CAS RN: 50605-13-5
CAS Name: N-[2,2-dimethyl-6,8-bis(phenylmethoxy)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl]acetamide
OPENEYE Name: N-(6,8-dibenzyloxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl)acetamide
IUPAC Name: N-[2,2-dimethyl-6,8-bis(phenylmethoxy)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl]acetamide
SYSTEMATIC NAME: N-[2,2-dimethyl-6,8-bis(phenylmethoxy)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl]ethanamide
MOLECULAR FORMULA: C25H31NO6
MOLECULAR WEIGHT: 441.51674
SMILES: CC(=O)NC1C(C2C(COC(O2)(C)C)OC1OCC3=CC=CC=C3)OCC4=CC=CC=C4
Structure:

CAS RN: 4710-90-1
CAS Name: N-[4,5-dihydroxy-6-(hydroxymethyl)-2-phenylmethoxy-3-oxanyl]benzamide
OPENEYE Name: N-[2-benzyloxy-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]benzamide
IUPAC Name: N-[4,5-dihydroxy-6-(hydroxymethyl)-2-phenylmethoxyoxan-3-yl]benzamide
SYSTEMATIC NAME: N-[6-(hydroxymethyl)-4,5-bis(oxidanyl)-2-phenylmethoxy-oxan-3-yl]benzamide
MOLECULAR FORMULA: C20H23NO6
MOLECULAR WEIGHT: 373.39972
SMILES: C1=CC=C(C=C1)COC2C(C(C(C(O2)CO)O)O)NC(=O)C3=CC=CC=C3
Structure:

CAS RN: 14855-31-3
CAS Name: N-[5-hydroxy-6-(hydroxymethyl)-2,4-bis(phenylmethoxy)-3-oxanyl]acetamide
OPENEYE Name: N-[2,4-dibenzyloxy-5-hydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]acetamide
IUPAC Name: N-[5-hydroxy-6-(hydroxymethyl)-2,4-bis(phenylmethoxy)oxan-3-yl]acetamide
SYSTEMATIC NAME: N-[6-(hydroxymethyl)-5-oxidanyl-2,4-bis(phenylmethoxy)oxan-3-yl]ethanamide
MOLECULAR FORMULA: C22H27NO6
MOLECULAR WEIGHT: 401.45288
SMILES: CC(=O)NC1C(C(C(OC1OCC2=CC=CC=C2)CO)O)OCC3=CC=CC=C3
Structure:

CAS RN: 59211-14-2
CAS Name: N-[5-amino-2,4-bis(phenylmethoxy)-6-[(triphenylmethyl)oxymethyl]-3-oxanyl]acetamide
OPENEYE Name: N-[5-amino-2,4-dibenzyloxy-6-(trityloxymethyl)tetrahydropyran-3-yl]acetamide
IUPAC Name: N-[5-amino-2,4-bis(phenylmethoxy)-6-(trityloxymethyl)oxan-3-yl]acetamide
SYSTEMATIC NAME: N-[5-azanyl-2,4-bis(phenylmethoxy)-6-[(triphenylmethyl)oxymethyl]oxan-3-yl]ethanamide
MOLECULAR FORMULA: C41H42N2O5
MOLECULAR WEIGHT: 642.78258
SMILES: CC(=O)NC1C(C(C(OC1OCC2=CC=CC=C2)COC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)N)OCC6=CC=CC=C6
Structure:

CAS RN: 91927-50-3
CAS Name: N-[2,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)-3-oxanyl]acetamide
OPENEYE Name: N-[2,4,5-tribenzyloxy-6-(benzyloxymethyl)tetrahydropyran-3-yl]acetamide
IUPAC Name: N-[2,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-yl]acetamide
SYSTEMATIC NAME: N-[2,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-yl]ethanamide
MOLECULAR FORMULA: C36H39NO6
MOLECULAR WEIGHT: 581.69796
SMILES: CC(=O)NC1C(C(C(OC1OCC2=CC=CC=C2)COCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5
Structure:

CAS RN: 13121-61-4
CAS Name: acetic acid (3,4,5-triacetyloxy-2-oxanyl)methyl ester
OPENEYE Name: (3,4,5-triacetoxytetrahydropyran-2-yl)methyl acetate
IUPAC Name: (3,4,5-triacetyloxyoxan-2-yl)methyl acetate
SYSTEMATIC NAME: (3,4,5-triacetyloxyoxan-2-yl)methyl ethanoate
MOLECULAR FORMULA: C14H20O9
MOLECULAR WEIGHT: 332.3032
SMILES: CC(=O)OCC1C(C(C(CO1)OC(=O)C)OC(=O)C)OC(=O)C
Structure:

CAS RN: 85906-16-7
CAS Name: 4-methylbenzenesulfonic acid (3,4,5-trihydroxy-2-oxanyl)methyl ester
OPENEYE Name: (3,4,5-trihydroxytetrahydropyran-2-yl)methyl 4-methylbenzenesulfonate
IUPAC Name: (3,4,5-trihydroxyoxan-2-yl)methyl 4-methylbenzenesulfonate
SYSTEMATIC NAME: [3,4,5-tris(oxidanyl)oxan-2-yl]methyl 4-methylbenzenesulfonate
MOLECULAR FORMULA: C13H18O7S
MOLECULAR WEIGHT: 318.34282
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(C(CO2)O)O)O
Structure:

CAS RN: 85906-19-0
CAS Name: benzoic acid [4,5-dibenzoyloxy-6-[(4-methylphenyl)sulfonyloxymethyl]-3-oxanyl] ester
OPENEYE Name: [4,5-dibenzoyloxy-6-(p-tolylsulfonyloxymethyl)tetrahydropyran-3-yl] benzoate
IUPAC Name: [4,5-dibenzoyloxy-6-[(4-methylphenyl)sulfonyloxymethyl]oxan-3-yl] benzoate
SYSTEMATIC NAME: [6-[(4-methylphenyl)sulfonyloxymethyl]-4,5-bis(phenylcarbonyloxy)oxan-3-yl] benzoate
MOLECULAR FORMULA: C34H30O10S
MOLECULAR WEIGHT: 630.661
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(C(CO2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5
Structure:

CAS RN: 4064-29-3
CAS Name: benzoic acid (4-benzoyloxy-5-hydroxy-3-oxanyl) ester
OPENEYE Name: (4-benzoyloxy-5-hydroxy-tetrahydropyran-3-yl) benzoate
IUPAC Name: (4-benzoyloxy-5-hydroxyoxan-3-yl) benzoate
SYSTEMATIC NAME: [5-oxidanyl-4-(phenylcarbonyloxy)oxan-3-yl] benzoate
MOLECULAR FORMULA: C19H18O6
MOLECULAR WEIGHT: 342.34262
SMILES: C1C(C(C(CO1)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)O
Structure:

CAS RN: 3969-79-7
CAS Name: 5-phenylmethoxyoxane-3,4-diol
OPENEYE Name: 5-benzyloxytetrahydropyran-3,4-diol
IUPAC Name: 5-phenylmethoxyoxane-3,4-diol
SYSTEMATIC NAME: 5-phenylmethoxyoxane-3,4-diol
MOLECULAR FORMULA: C12H16O4
MOLECULAR WEIGHT: 224.25304
SMILES: C1C(C(C(CO1)OCC2=CC=CC=C2)O)O
Structure:

CAS RN: 27975-19-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H30O3
MOLECULAR WEIGHT: 318.4504
SMILES: CC12CCC3C4(CCCC(C4CCC3(C1)CC2=O)(C)C(=O)O)C
Structure:

CAS RN: 69370-72-5
CAS Name: benzoic acid [2,3-dibenzoyloxy-5-methoxy-6-(methoxymethyl)-4-oxanyl] ester
OPENEYE Name: [2,3-dibenzoyloxy-5-methoxy-6-(methoxymethyl)tetrahydropyran-4-yl] benzoate
IUPAC Name: [2,3-dibenzoyloxy-5-methoxy-6-(methoxymethyl)oxan-4-yl] benzoate
SYSTEMATIC NAME: [3-methoxy-2-(methoxymethyl)-5,6-bis(phenylcarbonyloxy)oxan-4-yl] benzoate
MOLECULAR FORMULA: C29H28O9
MOLECULAR WEIGHT: 520.52722
SMILES: COCC1C(C(C(C(O1)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC
Structure:

CAS RN: 21056-52-0
CAS Name: benzoic acid [3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl] ester
OPENEYE Name: [3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] benzoate
IUPAC Name: [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] benzoate
SYSTEMATIC NAME: [6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl] benzoate
MOLECULAR FORMULA: C13H16O7
MOLECULAR WEIGHT: 284.26194
SMILES: C1=CC=C(C=C1)C(=O)OC2C(C(C(C(O2)CO)O)O)O
Structure:

CAS RN: 13036-15-2
CAS Name: acetic acid (3,4,6-triacetyloxy-5-hydroxy-2-oxanyl)methyl ester
OPENEYE Name: (3,4,6-triacetoxy-5-hydroxy-tetrahydropyran-2-yl)methyl acetate
IUPAC Name: (3,4,6-triacetyloxy-5-hydroxyoxan-2-yl)methyl acetate
SYSTEMATIC NAME: (3,4,6-triacetyloxy-5-oxidanyl-oxan-2-yl)methyl ethanoate
MOLECULAR FORMULA: C14H20O10
MOLECULAR WEIGHT: 348.3026
SMILES: CC(=O)OCC1C(C(C(C(O1)OC(=O)C)O)OC(=O)C)OC(=O)C
Structure:

CAS RN: 22415-91-4
CAS Name: benzoic acid (3,4,5,6-tetrabenzoyloxy-2-oxanyl)methyl ester
OPENEYE Name: (3,4,5,6-tetrabenzoyloxytetrahydropyran-2-yl)methyl benzoate
IUPAC Name: (3,4,5,6-tetrabenzoyloxyoxan-2-yl)methyl benzoate
SYSTEMATIC NAME: [3,4,5,6-tetrakis(phenylcarbonyloxy)oxan-2-yl]methyl benzoate
MOLECULAR FORMULA: C41H32O11
MOLECULAR WEIGHT: 700.68618
SMILES: C1=CC=C(C=C1)C(=O)OCC2C(C(C(C(O2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6
Structure:

CAS RN: 35526-19-3
CAS Name: benzoic acid (3,4-dibenzoyloxy-1-hydroxy-5-oxopentan-2-yl) ester
OPENEYE Name: [2,3-dibenzoyloxy-1-(hydroxymethyl)-4-oxo-butyl] benzoate
IUPAC Name: (3,4-dibenzoyloxy-1-hydroxy-5-oxopentan-2-yl) benzoate
SYSTEMATIC NAME: [1-oxidanyl-5-oxidanylidene-3,4-bis(phenylcarbonyloxy)pentan-2-yl] benzoate
MOLECULAR FORMULA: C26H22O8
MOLECULAR WEIGHT: 462.44808
SMILES: C1=CC=C(C=C1)C(=O)OC(CO)C(C(C=O)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3
Structure:

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