Product OPENEYE NAME: bis(2-ethylhexyl) nonanedioate
CAS Name: nonanedioic acid bis(2-ethylhexyl) ester
IUPAC NAME: bis(2-ethylhexyl) nonanedioate
SYSTEMATIC NAME: bis(2-ethylhexyl) nonanedioate
MOLECULAR FORMULA: C25H48O4
MOLECULAR WEIGHT: 412.64622
SMILES: CCCCC(CC)COC(=O)CCCCCCCC(=O)OCC(CC)CCCC
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Product OPENEYE NAME: methyl 3-phenylpropanoate
CAS Name: 3-phenylpropanoic acid methyl ester
IUPAC NAME: methyl 3-phenylpropanoate
SYSTEMATIC NAME: methyl 3-phenylpropanoate
MOLECULAR FORMULA: C10H12O2
MOLECULAR WEIGHT: 164.20108
SMILES: COC(=O)CCC1=CC=CC=C1
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Product OPENEYE NAME: methyl 3-phenylprop-2-enoate
CAS Name: 3-phenyl-2-propenoic acid methyl ester
IUPAC NAME: methyl 3-phenylprop-2-enoate
SYSTEMATIC NAME: methyl 3-phenylprop-2-enoate
MOLECULAR FORMULA: C10H10O2
MOLECULAR WEIGHT: 162.1852
SMILES: COC(=O)C=CC1=CC=CC=C1
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Product OPENEYE NAME: phenylmercury; propionic acid
CAS Name: phenylmercury; propanoic acid
IUPAC NAME: phenylmercury; propanoic acid
SYSTEMATIC NAME: phenylmercury; propanoic acid
MOLECULAR FORMULA: C9H11HgO2
MOLECULAR WEIGHT: 351.77244
SMILES: CCC(=O)O.C1=CC=C(C=C1)[Hg]
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Product OPENEYE NAME: benzyl 2-methylpropanoate
CAS Name: 2-methylpropanoic acid (phenylmethyl) ester
IUPAC NAME: benzyl 2-methylpropanoate
SYSTEMATIC NAME: (phenylmethyl) 2-methylpropanoate
MOLECULAR FORMULA: C11H14O2
MOLECULAR WEIGHT: 178.22766
SMILES: CC(C)C(=O)OCC1=CC=CC=C1
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Product OPENEYE NAME: 2-phenylethylbenzene
CAS Name: 2-phenylethylbenzene
IUPAC NAME: 2-phenylethylbenzene
SYSTEMATIC NAME: 2-phenylethylbenzene
MOLECULAR FORMULA: C14H14
MOLECULAR WEIGHT: 182.26096
SMILES: C1=CC=C(C=C1)CCC2=CC=CC=C2
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Product OPENEYE NAME: 4-(morpholinodisulfanyl)morpholine
CAS Name: 4-(4-morpholinyldisulfanyl)morpholine
IUPAC NAME: 4-(morpholin-4-yldisulfanyl)morpholine
SYSTEMATIC NAME: 4-(morpholin-4-yldisulfanyl)morpholine
MOLECULAR FORMULA: C8H16N2O2S2
MOLECULAR WEIGHT: 236.35484
SMILES: C1COCCN1SSN2CCOCC2
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Product OPENEYE NAME: ethyl 3-phenylprop-2-enoate
CAS Name: 3-phenyl-2-propenoic acid ethyl ester
IUPAC NAME: ethyl 3-phenylprop-2-enoate
SYSTEMATIC NAME: ethyl 3-phenylprop-2-enoate
MOLECULAR FORMULA: C11H12O2
MOLECULAR WEIGHT: 176.21178
SMILES: CCOC(=O)C=CC1=CC=CC=C1
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Product OPENEYE NAME: benzyl butanoate
CAS Name: butanoic acid (phenylmethyl) ester
IUPAC NAME: benzyl butanoate
SYSTEMATIC NAME: (phenylmethyl) butanoate
MOLECULAR FORMULA: C11H14O2
MOLECULAR WEIGHT: 178.22766
SMILES: CCCC(=O)OCC1=CC=CC=C1
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Product OPENEYE NAME: benzyl 3-methylbutanoate
CAS Name: 3-methylbutanoic acid (phenylmethyl) ester
IUPAC NAME: benzyl 3-methylbutanoate
SYSTEMATIC NAME: (phenylmethyl) 3-methylbutanoate
MOLECULAR FORMULA: C12H16O2
MOLECULAR WEIGHT: 192.25424
SMILES: CC(C)CC(=O)OCC1=CC=CC=C1
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Product OPENEYE NAME: benzyl 3-phenylprop-2-enoate
CAS Name: 3-phenyl-2-propenoic acid (phenylmethyl) ester
IUPAC NAME: benzyl 3-phenylprop-2-enoate
SYSTEMATIC NAME: (phenylmethyl) 3-phenylprop-2-enoate
MOLECULAR FORMULA: C16H14O2
MOLECULAR WEIGHT: 238.28116
SMILES: C1=CC=C(C=C1)COC(=O)C=CC2=CC=CC=C2
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Product OPENEYE NAME: dibenzyl butanedioate
CAS Name: butanedioic acid bis(phenylmethyl) ester
IUPAC NAME: dibenzyl butanedioate
SYSTEMATIC NAME: bis(phenylmethyl) butanedioate
MOLECULAR FORMULA: C18H18O4
MOLECULAR WEIGHT: 298.33312
SMILES: C1=CC=C(C=C1)COC(=O)CCC(=O)OCC2=CC=CC=C2
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Product OPENEYE NAME: 2-phenylethyl acetate
CAS Name: acetic acid 2-phenylethyl ester
IUPAC NAME: 2-phenylethyl acetate
SYSTEMATIC NAME: 2-phenylethyl ethanoate
MOLECULAR FORMULA: C10H12O2
MOLECULAR WEIGHT: 164.20108
SMILES: CC(=O)OCCC1=CC=CC=C1
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Product OPENEYE NAME: 2-phenylethyl 2-methylpropanoate
CAS Name: 2-methylpropanoic acid 2-phenylethyl ester
IUPAC NAME: 2-phenylethyl 2-methylpropanoate
SYSTEMATIC NAME: 2-phenylethyl 2-methylpropanoate
MOLECULAR FORMULA: C12H16O2
MOLECULAR WEIGHT: 192.25424
SMILES: CC(C)C(=O)OCCC1=CC=CC=C1
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Product OPENEYE NAME: N-benzyl-1-phenyl-methanamine
CAS Name: 1-phenyl-N-(phenylmethyl)methanamine
IUPAC NAME: N-benzyl-1-phenylmethanamine
SYSTEMATIC NAME: 1-phenyl-N-(phenylmethyl)methanamine
MOLECULAR FORMULA: C14H15N
MOLECULAR WEIGHT: 197.2756
SMILES: C1=CC=C(C=C1)CNCC2=CC=CC=C2
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Product OPENEYE NAME: benzyloxymethylbenzene
CAS Name: phenylmethoxymethylbenzene
IUPAC NAME: phenylmethoxymethylbenzene
SYSTEMATIC NAME: phenylmethoxymethylbenzene
MOLECULAR FORMULA: C14H14O
MOLECULAR WEIGHT: 198.26036
SMILES: C1=CC=C(C=C1)COCC2=CC=CC=C2
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Product OPENEYE NAME: 2-phenylethyl butanoate
CAS Name: butanoic acid 2-phenylethyl ester
IUPAC NAME: 2-phenylethyl butanoate
SYSTEMATIC NAME: 2-phenylethyl butanoate
MOLECULAR FORMULA: C12H16O2
MOLECULAR WEIGHT: 192.25424
SMILES: CCCC(=O)OCCC1=CC=CC=C1
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Product OPENEYE NAME: 2-phenylethyl 3-phenylprop-2-enoate
CAS Name: 3-phenyl-2-propenoic acid 2-phenylethyl ester
IUPAC NAME: 2-phenylethyl 3-phenylprop-2-enoate
SYSTEMATIC NAME: 2-phenylethyl 3-phenylprop-2-enoate
MOLECULAR FORMULA: C17H16O2
MOLECULAR WEIGHT: 252.30774
SMILES: C1=CC=C(C=C1)CCOC(=O)C=CC2=CC=CC=C2
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Product OPENEYE NAME: cinnamyl acetate
CAS Name: acetic acid 3-phenylprop-2-enyl ester
IUPAC NAME: 3-phenylprop-2-enyl acetate
SYSTEMATIC NAME: 3-phenylprop-2-enyl ethanoate
MOLECULAR FORMULA: C11H12O2
MOLECULAR WEIGHT: 176.21178
SMILES: CC(=O)OCC=CC1=CC=CC=C1
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