Product OPENEYE NAME: 2,3,4-trihydroxy-2,4-dinitro-butanal
CAS Name: 2,3,4-trihydroxy-2,4-dinitrobutanal
IUPAC NAME: 2,3,4-trihydroxy-2,4-dinitrobutanal
SYSTEMATIC NAME: 2,4-dinitro-2,3,4-tris(oxidanyl)butanal
MOLECULAR FORMULA: C4H6N2O8
MOLECULAR WEIGHT: 210.09904
SMILES: C(=O)C(C(C([N+](=O)[O-])O)O)([N+](=O)[O-])O
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Product OPENEYE NAME: lithium gold(1+) sulfite
CAS Name: lithium gold(1+) sulfite
IUPAC NAME: lithium gold(1+) sulfite
SYSTEMATIC NAME: lithium gold(1+) sulfite
MOLECULAR FORMULA: AuLiO3S
MOLECULAR WEIGHT: 283.97075
SMILES: [Li+].[O-]S(=O)[O-].[Au+]
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Product OPENEYE NAME: 1-(2-quinolyl)butane-2-sulfonic acid
CAS Name: 1-(2-quinolinyl)-2-butanesulfonic acid
IUPAC NAME: 1-quinolin-2-ylbutane-2-sulfonic acid
SYSTEMATIC NAME: 1-quinolin-2-ylbutane-2-sulfonic acid
MOLECULAR FORMULA: C13H15NO3S
MOLECULAR WEIGHT: 265.3281
SMILES: CCC(CC1=NC2=CC=CC=C2C=C1)S(=O)(=O)O
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Product OPENEYE NAME: 2,4,6-trimethyl-1-prop-2-ynyl-pyridin-1-ium bromide
CAS Name: 2,4,6-trimethyl-1-prop-2-ynylpyridin-1-ium bromide
IUPAC NAME: 2,4,6-trimethyl-1-prop-2-ynylpyridin-1-ium bromide
SYSTEMATIC NAME: 2,4,6-trimethyl-1-prop-2-ynyl-pyridin-1-ium bromide
MOLECULAR FORMULA: C11H14BrN
MOLECULAR WEIGHT: 240.13956
SMILES: CC1=CC(=[N+](C(=C1)C)CC#C)C.[Br-]
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Product OPENEYE NAME: 2,4,6-trimethyl-1-prop-2-ynyl-pyridin-1-ium
CAS Name: 2,4,6-trimethyl-1-prop-2-ynylpyridin-1-ium
IUPAC NAME: 2,4,6-trimethyl-1-prop-2-ynylpyridin-1-ium
SYSTEMATIC NAME: 2,4,6-trimethyl-1-prop-2-ynyl-pyridin-1-ium
MOLECULAR FORMULA: C11H14N+
MOLECULAR WEIGHT: 160.23556
SMILES: CC1=CC(=[N+](C(=C1)C)CC#C)C
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Product OPENEYE NAME: 3-[allyl(sulfamoyl)amino]prop-1-ene
CAS Name: 3-[prop-2-enyl(sulfamoyl)amino]-1-propene
IUPAC NAME: 3-[prop-2-enyl(sulfamoyl)amino]prop-1-ene
SYSTEMATIC NAME: 3-[prop-2-enyl(sulfamoyl)amino]prop-1-ene
MOLECULAR FORMULA: C6H12N2O2S
MOLECULAR WEIGHT: 176.23668
SMILES: C=CCN(CC=C)S(=O)(=O)N
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Product OPENEYE NAME: 2-(2,3-dibromopropyl)-1-methyl-1H-isoquinoline
CAS Name: 2-(2,3-dibromopropyl)-1-methyl-1H-isoquinoline
IUPAC NAME: 2-(2,3-dibromopropyl)-1-methyl-1H-isoquinoline
SYSTEMATIC NAME: 2-[2,3-bis(bromanyl)propyl]-1-methyl-1H-isoquinoline
MOLECULAR FORMULA: C13H15Br2N
MOLECULAR WEIGHT: 345.0729
SMILES: CC1C2=CC=CC=C2C=CN1CC(CBr)Br
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Product OPENEYE NAME: 2-(diethylamino)pent-3-yn-2-ol
CAS Name: 2-(diethylamino)-3-pentyn-2-ol
IUPAC NAME: 2-(diethylamino)pent-3-yn-2-ol
SYSTEMATIC NAME: 2-(diethylamino)pent-3-yn-2-ol
MOLECULAR FORMULA: C9H17NO
MOLECULAR WEIGHT: 155.23738
SMILES: CCN(CC)C(C)(C#CC)O
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Product OPENEYE NAME: 1-[4-(2-hydroxybut-3-enoxy)but-2-ynoxy]but-3-en-2-ol
CAS Name: 1-[4-(2-hydroxybut-3-enoxy)but-2-ynoxy]-3-buten-2-ol
IUPAC NAME: 1-[4-(2-hydroxybut-3-enoxy)but-2-ynoxy]but-3-en-2-ol
SYSTEMATIC NAME: 1-[4-(2-oxidanylbut-3-enoxy)but-2-ynoxy]but-3-en-2-ol
MOLECULAR FORMULA: C12H18O4
MOLECULAR WEIGHT: 226.26892
SMILES: C=CC(COCC#CCOCC(C=C)O)O
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Product OPENEYE NAME: N,N-dimethylhex-2-yn-1-amine
CAS Name: N,N-dimethyl-2-hexyn-1-amine
IUPAC NAME: N,N-dimethylhex-2-yn-1-amine
SYSTEMATIC NAME: N,N-dimethylhex-2-yn-1-amine
MOLECULAR FORMULA: C8H15N
MOLECULAR WEIGHT: 125.2114
SMILES: CCCC#CCN(C)C
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Product OPENEYE NAME: but-1-yne-1-sulfonic acid
CAS Name: 1-butyne-1-sulfonic acid
IUPAC NAME: but-1-yne-1-sulfonic acid
SYSTEMATIC NAME: but-1-yne-1-sulfonic acid
MOLECULAR FORMULA: C4H6O3S
MOLECULAR WEIGHT: 134.15364
SMILES: CCC#CS(=O)(=O)O
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Product OPENEYE NAME: 1-(1-isoquinolyl)butane-2-sulfonic acid
CAS Name: 1-(1-isoquinolinyl)-2-butanesulfonic acid
IUPAC NAME: 1-isoquinolin-1-ylbutane-2-sulfonic acid
SYSTEMATIC NAME: 1-isoquinolin-1-ylbutane-2-sulfonic acid
MOLECULAR FORMULA: C13H15NO3S
MOLECULAR WEIGHT: 265.3281
SMILES: CCC(CC1=NC=CC2=CC=CC=C21)S(=O)(=O)O
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Product OPENEYE NAME: 3-(sulfamoylamino)prop-1-ene
CAS Name: 3-(sulfamoylamino)-1-propene
IUPAC NAME: 3-(sulfamoylamino)prop-1-ene
SYSTEMATIC NAME: 3-(sulfamoylamino)prop-1-ene
MOLECULAR FORMULA: C3H8N2O2S
MOLECULAR WEIGHT: 136.17282
SMILES: C=CCNS(=O)(=O)N
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