Product OPENEYE NAME: hexacosane
CAS Name: hexacosane
IUPAC NAME: hexacosane
SYSTEMATIC NAME: hexacosane
MOLECULAR FORMULA: C26H54
MOLECULAR WEIGHT: 366.70696
SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCC
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Product OPENEYE NAME: octacosane
CAS Name: octacosane
IUPAC NAME: octacosane
SYSTEMATIC NAME: octacosane
MOLECULAR FORMULA: C28H58
MOLECULAR WEIGHT: 394.76012
SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCC
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Product OPENEYE NAME: nonacosane
CAS Name: nonacosane
IUPAC NAME: nonacosane
SYSTEMATIC NAME: nonacosane
MOLECULAR FORMULA: C29H60
MOLECULAR WEIGHT: 408.7867
SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCC
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Product OPENEYE NAME: hentriacontane
CAS Name: hentriacontane
IUPAC NAME: hentriacontane
SYSTEMATIC NAME: hentriacontane
MOLECULAR FORMULA: C31H64
MOLECULAR WEIGHT: 436.83986
SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
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Product OPENEYE NAME: tritriacontane
CAS Name: tritriacontane
IUPAC NAME: tritriacontane
SYSTEMATIC NAME: tritriacontane
MOLECULAR FORMULA: C33H68
MOLECULAR WEIGHT: 464.89302
SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
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Product OPENEYE NAME: hexatriacontane
CAS Name: hexatriacontane
IUPAC NAME: hexatriacontane
SYSTEMATIC NAME: hexatriacontane
MOLECULAR FORMULA: C36H74
MOLECULAR WEIGHT: 506.97276
SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
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Product OPENEYE NAME: pentatriacontane
CAS Name: pentatriacontane
IUPAC NAME: pentatriacontane
SYSTEMATIC NAME: pentatriacontane
MOLECULAR FORMULA: C35H72
MOLECULAR WEIGHT: 492.94618
SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
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Product OPENEYE NAME: 1-bromo-2,2-dimethyl-propane
CAS Name: 1-bromo-2,2-dimethylpropane
IUPAC NAME: 1-bromo-2,2-dimethylpropane
SYSTEMATIC NAME: 1-bromanyl-2,2-dimethyl-propane
MOLECULAR FORMULA: C5H11Br
MOLECULAR WEIGHT: 151.04484
SMILES: CC(C)(C)CBr
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Product OPENEYE NAME: 2,2-dimethylpropanenitrile
CAS Name: 2,2-dimethylpropanenitrile
IUPAC NAME: 2,2-dimethylpropanenitrile
SYSTEMATIC NAME: 2,2-dimethylpropanenitrile
MOLECULAR FORMULA: C5H9N
MOLECULAR WEIGHT: 83.13166
SMILES: CC(C)(C)C#N
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Product OPENEYE NAME: 2,2-dimethylpropanal
CAS Name: 2,2-dimethylpropanal
IUPAC NAME: 2,2-dimethylpropanal
SYSTEMATIC NAME: 2,2-dimethylpropanal
MOLECULAR FORMULA: C5H10O
MOLECULAR WEIGHT: 86.1323
SMILES: CC(C)(C)C=O
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Product OPENEYE NAME: 1,1,1,2-tetrachloroethane
CAS Name: 1,1,1,2-tetrachloroethane
IUPAC NAME: 1,1,1,2-tetrachloroethane
SYSTEMATIC NAME: 1,1,1,2-tetrakis(chloranyl)ethane
MOLECULAR FORMULA: C2H2Cl4
MOLECULAR WEIGHT: 167.84928
SMILES: C(C(Cl)(Cl)Cl)Cl
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Product OPENEYE NAME: [(9S,14S,17R)-17-acetyl-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] hexanoate
CAS Name: hexanoic acid [(9S,14S,17R)-17-acetyl-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] ester
IUPAC NAME: [(9S,14S,17R)-17-acetyl-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] hexanoate
SYSTEMATIC NAME: [(9S,14S,17R)-17-ethanoyl-10,13-dimethyl-3-oxidanylidene-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] hexanoate
MOLECULAR FORMULA: C27H40O4
MOLECULAR WEIGHT: 428.6041
SMILES: CCCCCC(=O)O[C@@]1(CC[C@@H]2C1(CC[C@H]3C2CCC4=CC(=O)CCC34C)C)C(=O)C
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Product OPENEYE NAME: 3-[(1R,3S,5S,10R,11R,13R,14S,17R)-1,5,11,14-tetrahydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
CAS Name: 3-[(1R,3S,5S,10R,11R,13R,14S,17R)-1,5,11,14-tetrahydroxy-10-(hydroxymethyl)-13-methyl-3-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxy]-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
IUPAC NAME: 3-[(1R,3S,5S,10R,11R,13R,14S,17R)-1,5,11,14-tetrahydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
SYSTEMATIC NAME: 3-[(1R,3S,5S,10R,11R,13R,14S,17R)-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5R,6S)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-1,5,11,14-tetrakis(oxidanyl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
MOLECULAR FORMULA: C29H44O12
MOLECULAR WEIGHT: 584.65246
SMILES: C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2C[C@H]([C@@]3(C4[C@@H](C[C@@]5([C@H](CC[C@@]5(C4CC[C@@]3(C2)O)O)C6=CC(=O)OC6)C)O)CO)O)O)O)O
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Product OPENEYE NAME: 3-[2-(11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxo-ethoxy]carbonylbenzenesulfonic acid
CAS Name: 3-[[2-(11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoethoxy]-oxomethyl]benzenesulfonic acid
IUPAC NAME: 3-[2-(11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoethoxy]carbonylbenzenesulfonic acid
SYSTEMATIC NAME: 3-[2-[10,13-dimethyl-11,17-bis(oxidanyl)-3-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxidanylidene-ethoxy]carbonylbenzenesulfonic acid
MOLECULAR FORMULA: C28H32O9S
MOLECULAR WEIGHT: 544.61328
SMILES: CC12CC(C3C(C1CCC2(C(=O)COC(=O)C4=CC(=CC=C4)S(=O)(=O)O)O)CCC5=CC(=O)C=CC35C)O
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Product OPENEYE NAME: iodo(trinitro)methane
CAS Name: iodo(trinitro)methane
IUPAC NAME: iodo(trinitro)methane
SYSTEMATIC NAME: iodanyl(trinitro)methane
MOLECULAR FORMULA: CIN3O6
MOLECULAR WEIGHT: 276.93167
SMILES: C([N+](=O)[O-])([N+](=O)[O-])([N+](=O)[O-])I
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Product OPENEYE NAME: tritylbenzene
CAS Name: (triphenylmethyl)benzene
IUPAC NAME: tritylbenzene
SYSTEMATIC NAME: (triphenylmethyl)benzene
MOLECULAR FORMULA: C25H20
MOLECULAR WEIGHT: 320.4263
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: tetraethylsilane
CAS Name: tetraethylsilane
IUPAC NAME: tetraethylsilane
SYSTEMATIC NAME: tetraethylsilane
MOLECULAR FORMULA: C8H20Si
MOLECULAR WEIGHT: 144.3299
SMILES: CC[Si](CC)(CC)CC
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