Product OPENEYE NAME: 2-iodophenol
CAS Name: 2-iodophenol
IUPAC NAME: 2-iodophenol
SYSTEMATIC NAME: 2-iodanylphenol
MOLECULAR FORMULA: C6H5IO
MOLECULAR WEIGHT: 220.00777
SMILES: C1=CC=C(C(=C1)O)I
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Product OPENEYE NAME: 2-hydroxycyclohexanone
CAS Name: 2-hydroxy-1-cyclohexanone
IUPAC NAME: 2-hydroxycyclohexan-1-one
SYSTEMATIC NAME: 2-oxidanylcyclohexan-1-one
MOLECULAR FORMULA: C6H10O2
MOLECULAR WEIGHT: 114.1424
SMILES: C1CCC(=O)C(C1)O
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Product OPENEYE NAME: 3,4,5-trihydroxypentanal
CAS Name: 3,4,5-trihydroxypentanal
IUPAC NAME: 3,4,5-trihydroxypentanal
SYSTEMATIC NAME: 3,4,5-tris(oxidanyl)pentanal
MOLECULAR FORMULA: C5H10O4
MOLECULAR WEIGHT: 134.1305
SMILES: C(C=O)C(C(CO)O)O
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Product OPENEYE NAME: benzene-1,2,4-triol
CAS Name: benzene-1,2,4-triol
IUPAC NAME: benzene-1,2,4-triol
SYSTEMATIC NAME: benzene-1,2,4-triol
MOLECULAR FORMULA: C6H6O3
MOLECULAR WEIGHT: 126.11004
SMILES: C1=CC(=C(C=C1O)O)O
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Product OPENEYE NAME: 3,5-dimethyl-1,3,5-thiadiazinane-2-thione
CAS Name: 3,5-dimethyl-1,3,5-thiadiazinane-2-thione
IUPAC NAME: 3,5-dimethyl-1,3,5-thiadiazinane-2-thione
SYSTEMATIC NAME: 3,5-dimethyl-1,3,5-thiadiazinane-2-thione
MOLECULAR FORMULA: C5H10N2S2
MOLECULAR WEIGHT: 162.2763
SMILES: CN1CN(C(=S)SC1)C
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Product OPENEYE NAME: 2-hydroxycyclohepta-2,4,6-trien-1-one
CAS Name: 2-hydroxy-1-cyclohepta-2,4,6-trienone
IUPAC NAME: 2-hydroxycyclohepta-2,4,6-trien-1-one
SYSTEMATIC NAME: 2-oxidanylcyclohepta-2,4,6-trien-1-one
MOLECULAR FORMULA: C7H6O2
MOLECULAR WEIGHT: 122.12134
SMILES: C1=CC=C(C(=O)C=C1)O
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Product OPENEYE NAME: 9,10,16-trihydroxyhexadecanoic acid
CAS Name: 9,10,16-trihydroxyhexadecanoic acid
IUPAC NAME: 9,10,16-trihydroxyhexadecanoic acid
SYSTEMATIC NAME: 9,10,16-tris(oxidanyl)hexadecanoic acid
MOLECULAR FORMULA: C16H32O5
MOLECULAR WEIGHT: 304.42228
SMILES: C(CCCC(C(CCCCCCO)O)O)CCCC(=O)O
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Product OPENEYE NAME: trisodium hydrogen carbonate carbonate
CAS Name: trisodium hydrogen carbonate carbonate
IUPAC NAME: trisodium hydrogen carbonate carbonate
SYSTEMATIC NAME: trisodium hydrogen carbonate carbonate
MOLECULAR FORMULA: C2HNa3O6
MOLECULAR WEIGHT: 189.99505
SMILES: C(=O)(O)[O-].C(=O)([O-])[O-].[Na+].[Na+].[Na+]
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Product OPENEYE NAME: 1,2-dibromobutane
CAS Name: 1,2-dibromobutane
IUPAC NAME: 1,2-dibromobutane
SYSTEMATIC NAME: 1,2-bis(bromanyl)butane
MOLECULAR FORMULA: C4H8Br2
MOLECULAR WEIGHT: 215.91432
SMILES: CCC(CBr)Br
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Product OPENEYE NAME: 1,3-dichloropropan-2-one
CAS Name: 1,3-dichloro-2-propanone
IUPAC NAME: 1,3-dichloropropan-2-one
SYSTEMATIC NAME: 1,3-bis(chloranyl)propan-2-one
MOLECULAR FORMULA: C3H4Cl2O
MOLECULAR WEIGHT: 126.96926
SMILES: C(C(=O)CCl)Cl
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Product OPENEYE NAME: 1,1-dimethoxyethane
CAS Name: 1,1-dimethoxyethane
IUPAC NAME: 1,1-dimethoxyethane
SYSTEMATIC NAME: 1,1-dimethoxyethane
MOLECULAR FORMULA: C4H10O2
MOLECULAR WEIGHT: 90.121
SMILES: CC(OC)OC
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Product OPENEYE NAME: dicesium carbonate
CAS Name: dicesium carbonate
IUPAC NAME: dicesium carbonate
SYSTEMATIC NAME: dicesium carbonate
MOLECULAR FORMULA: CCs2O3
MOLECULAR WEIGHT: 325.8198
SMILES: C(=O)([O-])[O-].[Cs+].[Cs+]
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Product OPENEYE NAME: 2-methylfuran
CAS Name: 2-methylfuran
IUPAC NAME: 2-methylfuran
SYSTEMATIC NAME: 2-methylfuran
MOLECULAR FORMULA: C5H6O
MOLECULAR WEIGHT: 82.10054
SMILES: CC1=CC=CO1
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Product OPENEYE NAME: 2-methyl-4,5-dihydro-1H-imidazole
CAS Name: 2-methyl-4,5-dihydro-1H-imidazole
IUPAC NAME: 2-methyl-4,5-dihydro-1H-imidazole
SYSTEMATIC NAME: 2-methyl-4,5-dihydro-1H-imidazole
MOLECULAR FORMULA: C4H8N2
MOLECULAR WEIGHT: 84.11972
SMILES: CC1=NCCN1
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Product OPENEYE NAME: (3-acetamido-4-hydroxy-phenyl)arsonic acid; N-ethylethanamine
CAS Name: (3-acetamido-4-hydroxyphenyl)arsonic acid; N-ethylethanamine
IUPAC NAME: (3-acetamido-4-hydroxyphenyl)arsonic acid; N-ethylethanamine
SYSTEMATIC NAME: (3-acetamido-4-oxidanyl-phenyl)arsonic acid; N-ethylethanamine
MOLECULAR FORMULA: C12H21AsN2O5
MOLECULAR WEIGHT: 348.22714
SMILES: CCNCC.CC(=O)NC1=C(C=CC(=C1)[As](=O)(O)O)O
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