Product OPENEYE NAME: 2-(3,4-dimethoxyphenyl)-2H-chromene
CAS Name: 2-(3,4-dimethoxyphenyl)-2H-1-benzopyran
IUPAC NAME: 2-(3,4-dimethoxyphenyl)-2H-chromene
SYSTEMATIC NAME: 2-(3,4-dimethoxyphenyl)-2H-chromene
MOLECULAR FORMULA: C17H16O3
MOLECULAR WEIGHT: 268.30714
SMILES: COC1=C(C=C(C=C1)C2C=CC3=CC=CC=C3O2)OC
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Product OPENEYE NAME: [(1E,3E)-hexa-1,3,5-trienyl]benzene; (2E,4E)-5-phenylpenta-2,4-dienenitrile
CAS Name: [(1E,3E)-hexa-1,3,5-trienyl]benzene; (2E,4E)-5-phenylpenta-2,4-dienenitrile
IUPAC NAME: [(1E,3E)-hexa-1,3,5-trienyl]benzene; (2E,4E)-5-phenylpenta-2,4-dienenitrile
SYSTEMATIC NAME: [(1E,3E)-hexa-1,3,5-trienyl]benzene; (2E,4E)-5-phenylpenta-2,4-dienenitrile
MOLECULAR FORMULA: C23H21N
MOLECULAR WEIGHT: 311.41954
SMILES: C=C/C=C/C=C/C1=CC=CC=C1.C1=CC=C(C=C1)/C=C/C=C/C#N
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Product OPENEYE NAME: 2-(2-hydroxy-3-oxo-cyclohepta-1,4,6-trien-1-yl)propanoic acid
CAS Name: 2-(2-hydroxy-3-oxo-1-cyclohepta-1,4,6-trienyl)propanoic acid
IUPAC NAME: 2-(2-hydroxy-3-oxocyclohepta-1,4,6-trien-1-yl)propanoic acid
SYSTEMATIC NAME: 2-(2-oxidanyl-3-oxidanylidene-cyclohepta-1,4,6-trien-1-yl)propanoic acid
MOLECULAR FORMULA: C10H10O4
MOLECULAR WEIGHT: 194.184
SMILES: CC(C1=C(C(=O)C=CC=C1)O)C(=O)O
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Product OPENEYE NAME: 3-benzylsulfonyl-2-hydroxy-cyclohepta-2,4,6-trien-1-one
CAS Name: 2-hydroxy-3-(phenylmethyl)sulfonyl-1-cyclohepta-2,4,6-trienone
IUPAC NAME: 3-benzylsulfonyl-2-hydroxycyclohepta-2,4,6-trien-1-one
SYSTEMATIC NAME: 2-oxidanyl-3-(phenylmethyl)sulfonyl-cyclohepta-2,4,6-trien-1-one
MOLECULAR FORMULA: C14H12O4S
MOLECULAR WEIGHT: 276.30768
SMILES: C1=CC=C(C=C1)CS(=O)(=O)C2=C(C(=O)C=CC=C2)O
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Product OPENEYE NAME: butyl 2-(2-hydroxy-3-oxo-cyclohepta-1,4,6-trien-1-yl)acetate
CAS Name: 2-(2-hydroxy-3-oxo-1-cyclohepta-1,4,6-trienyl)acetic acid butyl ester
IUPAC NAME: butyl 2-(2-hydroxy-3-oxocyclohepta-1,4,6-trien-1-yl)acetate
SYSTEMATIC NAME: butyl 2-(2-oxidanyl-3-oxidanylidene-cyclohepta-1,4,6-trien-1-yl)ethanoate
MOLECULAR FORMULA: C13H16O4
MOLECULAR WEIGHT: 236.26374
SMILES: CCCCOC(=O)CC1=C(C(=O)C=CC=C1)O
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Product OPENEYE NAME: propanoate nitrate
CAS Name: propanoate nitrate
IUPAC NAME: propanoate nitrate
SYSTEMATIC NAME: propanoate nitrate
MOLECULAR FORMULA: C3H5NO5-2
MOLECULAR WEIGHT: 135.0755
SMILES: CCC(=O)[O-].[N+](=O)([O-])[O-]
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Product OPENEYE NAME: 5-(4-methyl-2-thienyl)-1-(3-pyridyl)pentan-2-one
CAS Name: 5-(4-methyl-2-thiophenyl)-1-(3-pyridinyl)-2-pentanone
IUPAC NAME: 5-(4-methylthiophen-2-yl)-1-pyridin-3-ylpentan-2-one
SYSTEMATIC NAME: 5-(4-methylthiophen-2-yl)-1-pyridin-3-yl-pentan-2-one
MOLECULAR FORMULA: C15H17NOS
MOLECULAR WEIGHT: 259.36658
SMILES: CC1=CSC(=C1)CCCC(=O)CC2=CN=CC=C2
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Product OPENEYE NAME: 2-[2-(3-phenylpropyl)-3-pyridyl]ethanol
CAS Name: 2-[2-(3-phenylpropyl)-3-pyridinyl]ethanol
IUPAC NAME: 2-[2-(3-phenylpropyl)pyridin-3-yl]ethanol
SYSTEMATIC NAME: 2-[2-(3-phenylpropyl)pyridin-3-yl]ethanol
MOLECULAR FORMULA: C16H19NO
MOLECULAR WEIGHT: 241.32816
SMILES: C1=CC=C(C=C1)CCCC2=C(C=CC=N2)CCO
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Product OPENEYE NAME: 4-(4-methyl-2-thienyl)-3-oxo-butanoic acid
CAS Name: 4-(4-methyl-2-thiophenyl)-3-oxobutanoic acid
IUPAC NAME: 4-(4-methylthiophen-2-yl)-3-oxobutanoic acid
SYSTEMATIC NAME: 4-(4-methylthiophen-2-yl)-3-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C9H10O3S
MOLECULAR WEIGHT: 198.2389
SMILES: CC1=CSC(=C1)CC(=O)CC(=O)O
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Product OPENEYE NAME: 2-[2-[3-(4-methoxyphenyl)propyl]-4-pyridyl]ethanol
CAS Name: 2-[2-[3-(4-methoxyphenyl)propyl]-4-pyridinyl]ethanol
IUPAC NAME: 2-[2-[3-(4-methoxyphenyl)propyl]pyridin-4-yl]ethanol
SYSTEMATIC NAME: 2-[2-[3-(4-methoxyphenyl)propyl]pyridin-4-yl]ethanol
MOLECULAR FORMULA: C17H21NO2
MOLECULAR WEIGHT: 271.35414
SMILES: COC1=CC=C(C=C1)CCCC2=NC=CC(=C2)CCO
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Product OPENEYE NAME: 5-phenyl-1-(3-pyridyl)pentan-2-one
CAS Name: 5-phenyl-1-(3-pyridinyl)-2-pentanone
IUPAC NAME: 5-phenyl-1-pyridin-3-ylpentan-2-one
SYSTEMATIC NAME: 5-phenyl-1-pyridin-3-yl-pentan-2-one
MOLECULAR FORMULA: C16H17NO
MOLECULAR WEIGHT: 239.31228
SMILES: C1=CC=C(C=C1)CCCC(=O)CC2=CN=CC=C2
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