Product OPENEYE NAME: (1,5-dimethyl-1-vinyl-hex-4-enyl) acetate
CAS Name: acetic acid 3,7-dimethylocta-1,6-dien-3-yl ester
IUPAC NAME: 3,7-dimethylocta-1,6-dien-3-yl acetate
SYSTEMATIC NAME: 3,7-dimethylocta-1,6-dien-3-yl ethanoate
MOLECULAR FORMULA: C12H20O2
MOLECULAR WEIGHT: 196.286
SMILES: CC(=CCCC(C)(C=C)OC(=O)C)C
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Product OPENEYE NAME: tris(2-chloroethyl) phosphate
CAS Name: phosphoric acid tris(2-chloroethyl) ester
IUPAC NAME: tris(2-chloroethyl) phosphate
SYSTEMATIC NAME: tris(2-chloroethyl) phosphate
MOLECULAR FORMULA: C6H12Cl3O4P
MOLECULAR WEIGHT: 285.489841
SMILES: C(CCl)OP(=O)(OCCCl)OCCCl
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Product OPENEYE NAME: 1-chloro-2-[2-chloroethoxy(vinyl)phosphoryl]oxy-ethane
CAS Name: 1-chloro-2-[2-chloroethoxy(ethenyl)phosphoryl]oxyethane
IUPAC NAME: 1-chloro-2-[2-chloroethoxy(ethenyl)phosphoryl]oxyethane
SYSTEMATIC NAME: 1-chloranyl-2-[2-chloroethyloxy(ethenyl)phosphoryl]oxy-ethane
MOLECULAR FORMULA: C6H11Cl2O3P
MOLECULAR WEIGHT: 233.029501
SMILES: C=CP(=O)(OCCCl)OCCCl
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Product OPENEYE NAME: 2-dimethoxyphosphinothioylsulfanyl-N-ethyl-acetamide
CAS Name: 2-(dimethoxyphosphinothioylthio)-N-ethylacetamide
IUPAC NAME: 2-dimethoxyphosphinothioylsulfanyl-N-ethylacetamide
SYSTEMATIC NAME: 2-dimethoxyphosphinothioylsulfanyl-N-ethyl-ethanamide
MOLECULAR FORMULA: C6H14NO3PS2
MOLECULAR WEIGHT: 243.284021
SMILES: CCNC(=O)CSP(=S)(OC)OC
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Product OPENEYE NAME: 3,3,5-trimethylcyclohexanol
CAS Name: 3,3,5-trimethyl-1-cyclohexanol
IUPAC NAME: 3,3,5-trimethylcyclohexan-1-ol
SYSTEMATIC NAME: 3,3,5-trimethylcyclohexan-1-ol
MOLECULAR FORMULA: C9H18O
MOLECULAR WEIGHT: 142.23862
SMILES: CC1CC(CC(C1)(C)C)O
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Product OPENEYE NAME: 1-hydroxypropan-2-one
CAS Name: 1-hydroxy-2-propanone
IUPAC NAME: 1-hydroxypropan-2-one
SYSTEMATIC NAME: 1-oxidanylpropan-2-one
MOLECULAR FORMULA: C3H6O2
MOLECULAR WEIGHT: 74.07854
SMILES: CC(=O)CO
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Product OPENEYE NAME: 2-methoxyprop-1-ene
CAS Name: 2-methoxy-1-propene
IUPAC NAME: 2-methoxyprop-1-ene
SYSTEMATIC NAME: 2-methoxyprop-1-ene
MOLECULAR FORMULA: C4H8O
MOLECULAR WEIGHT: 72.10572
SMILES: CC(=C)OC
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Product OPENEYE NAME: 1,1,2,2-tetrafluoroethylene
CAS Name: 1,1,2,2-tetrafluoroethene
IUPAC NAME: 1,1,2,2-tetrafluoroethene
SYSTEMATIC NAME: 1,1,2,2-tetrakis(fluoranyl)ethene
MOLECULAR FORMULA: C2F4
MOLECULAR WEIGHT: 100.015013
SMILES: C(=C(F)F)(F)F
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Product OPENEYE NAME: 1,1,2,3,3,3-hexafluoroprop-1-ene
CAS Name: 1,1,2,3,3,3-hexafluoro-1-propene
IUPAC NAME: 1,1,2,3,3,3-hexafluoroprop-1-ene
SYSTEMATIC NAME: 1,1,2,3,3,3-hexakis(fluoranyl)prop-1-ene
MOLECULAR FORMULA: C3F6
MOLECULAR WEIGHT: 150.022519
SMILES: C(=C(F)F)(C(F)(F)F)F
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Product OPENEYE NAME: 1,1,1,3,3,3-hexachloropropan-2-one
CAS Name: 1,1,1,3,3,3-hexachloro-2-propanone
IUPAC NAME: 1,1,1,3,3,3-hexachloropropan-2-one
SYSTEMATIC NAME: 1,1,1,3,3,3-hexakis(chloranyl)propan-2-one
MOLECULAR FORMULA: C3Cl6O
MOLECULAR WEIGHT: 264.7495
SMILES: C(=O)(C(Cl)(Cl)Cl)C(Cl)(Cl)Cl
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Product OPENEYE NAME: triisopropyl phosphite
CAS Name: phosphorous acid tripropan-2-yl ester
IUPAC NAME: tripropan-2-yl phosphite
SYSTEMATIC NAME: tripropan-2-yl phosphite
MOLECULAR FORMULA: C9H21O3P
MOLECULAR WEIGHT: 208.235001
SMILES: CC(C)OP(OC(C)C)OC(C)C
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Product OPENEYE NAME: 1,2,4-trichloro-5-(4-chlorophenyl)sulfonyl-benzene
CAS Name: 1,2,4-trichloro-5-(4-chlorophenyl)sulfonylbenzene
IUPAC NAME: 1,2,4-trichloro-5-(4-chlorophenyl)sulfonylbenzene
SYSTEMATIC NAME: 1,2,4-tris(chloranyl)-5-(4-chlorophenyl)sulfonyl-benzene
MOLECULAR FORMULA: C12H6Cl4O2S
MOLECULAR WEIGHT: 356.05184
SMILES: C1=CC(=CC=C1S(=O)(=O)C2=CC(=C(C=C2Cl)Cl)Cl)Cl
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Product OPENEYE NAME: 1-[4-[1-[4-(2-hydroxypropoxy)phenyl]-1-methyl-ethyl]phenoxy]propan-2-ol
CAS Name: 1-[4-[2-[4-(2-hydroxypropoxy)phenyl]propan-2-yl]phenoxy]-2-propanol
IUPAC NAME: 1-[4-[2-[4-(2-hydroxypropoxy)phenyl]propan-2-yl]phenoxy]propan-2-ol
SYSTEMATIC NAME: 1-[4-[2-[4-(2-oxidanylpropoxy)phenyl]propan-2-yl]phenoxy]propan-2-ol
MOLECULAR FORMULA: C21H28O4
MOLECULAR WEIGHT: 344.44462
SMILES: CC(COC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCC(C)O)O
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Product OPENEYE NAME: ethyl-(3-hydroxyphenyl)-dimethyl-ammonium chloride
CAS Name: ethyl-(3-hydroxyphenyl)-dimethylammonium chloride
IUPAC NAME: ethyl-(3-hydroxyphenyl)-dimethylazanium chloride
SYSTEMATIC NAME: ethyl-(3-hydroxyphenyl)-dimethyl-azanium chloride
MOLECULAR FORMULA: C10H16ClNO
MOLECULAR WEIGHT: 201.69314
SMILES: CC[N+](C)(C)C1=CC(=CC=C1)O.[Cl-]
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Product OPENEYE NAME: 4-oxo-4-[4-(thiazol-2-ylsulfamoyl)anilino]butanoic acid hydrate
CAS Name: 4-oxo-4-[4-(2-thiazolylsulfamoyl)anilino]butanoic acid hydrate
IUPAC NAME: 4-oxo-4-[4-(1,3-thiazol-2-ylsulfamoyl)anilino]butanoic acid hydrate
SYSTEMATIC NAME: 4-oxidanylidene-4-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]amino]butanoic acid hydrate
MOLECULAR FORMULA: C13H15N3O6S2
MOLECULAR WEIGHT: 373.4047
SMILES: C1=CC(=CC=C1NC(=O)CCC(=O)O)S(=O)(=O)NC2=NC=CS2.O
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Product OPENEYE NAME: 4-amino-N-pyrazin-2-yl-benzenesulfonamide
CAS Name: 4-amino-N-(2-pyrazinyl)benzenesulfonamide
IUPAC NAME: 4-amino-N-pyrazin-2-ylbenzenesulfonamide
SYSTEMATIC NAME: 4-azanyl-N-pyrazin-2-yl-benzenesulfonamide
MOLECULAR FORMULA: C10H10N4O2S
MOLECULAR WEIGHT: 250.277
SMILES: C1=CC(=CC=C1N)S(=O)(=O)NC2=NC=CN=C2
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Product OPENEYE NAME: 4-amino-N-(5-bromo-4,6-dimethyl-pyrimidin-2-yl)benzenesulfonamide
CAS Name: 4-amino-N-(5-bromo-4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide
IUPAC NAME: 4-amino-N-(5-bromo-4,6-dimethylpyrimidin-2-yl)benzenesulfonamide
SYSTEMATIC NAME: 4-azanyl-N-(5-bromanyl-4,6-dimethyl-pyrimidin-2-yl)benzenesulfonamide
MOLECULAR FORMULA: C12H13BrN4O2S
MOLECULAR WEIGHT: 357.22622
SMILES: CC1=C(C(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N)C)Br
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Product OPENEYE NAME: [4-[(2-hydroxyacetyl)amino]phenyl]arsonic acid
CAS Name: [4-[(2-hydroxy-1-oxoethyl)amino]phenyl]arsonic acid
IUPAC NAME: [4-[(2-hydroxyacetyl)amino]phenyl]arsonic acid
SYSTEMATIC NAME: [4-(2-oxidanylethanoylamino)phenyl]arsonic acid
MOLECULAR FORMULA: C8H10AsNO5
MOLECULAR WEIGHT: 275.0903
SMILES: C1=CC(=CC=C1NC(=O)CO)[As](=O)(O)O
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Product OPENEYE NAME: 1,3-bis(2,2,2-trichloro-1-hydroxy-ethyl)urea
CAS Name: 1,3-bis(2,2,2-trichloro-1-hydroxyethyl)urea
IUPAC NAME: 1,3-bis(2,2,2-trichloro-1-hydroxyethyl)urea
SYSTEMATIC NAME: 1,3-bis[2,2,2-tris(chloranyl)-1-oxidanyl-ethyl]urea
MOLECULAR FORMULA: C5H6Cl6N2O3
MOLECULAR WEIGHT: 354.83074
SMILES: C(C(Cl)(Cl)Cl)(NC(=O)NC(C(Cl)(Cl)Cl)O)O
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Product OPENEYE NAME: 2-methylbutanoic acid
CAS Name: 2-methylbutanoic acid
IUPAC NAME: 2-methylbutanoic acid
SYSTEMATIC NAME: 2-methylbutanoic acid
MOLECULAR FORMULA: C5H10O2
MOLECULAR WEIGHT: 102.1317
SMILES: CCC(C)C(=O)O
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Product OPENEYE NAME: methyl 2,2-dichloroacetate
CAS Name: 2,2-dichloroacetic acid methyl ester
IUPAC NAME: methyl 2,2-dichloroacetate
SYSTEMATIC NAME: methyl 2,2-bis(chloranyl)ethanoate
MOLECULAR FORMULA: C3H4Cl2O2
MOLECULAR WEIGHT: 142.96866
SMILES: COC(=O)C(Cl)Cl
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Product OPENEYE NAME: 4-amino-3-hydroxy-naphthalene-1-sulfonic acid
CAS Name: 4-amino-3-hydroxy-1-naphthalenesulfonic acid
IUPAC NAME: 4-amino-3-hydroxynaphthalene-1-sulfonic acid
SYSTEMATIC NAME: 4-azanyl-3-oxidanyl-naphthalene-1-sulfonic acid
MOLECULAR FORMULA: C10H9NO4S
MOLECULAR WEIGHT: 239.24776
SMILES: C1=CC=C2C(=C1)C(=CC(=C2N)O)S(=O)(=O)O
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