Product OPENEYE NAME: N-(4-nitrophenyl)acetamide
CAS Name: N-(4-nitrophenyl)acetamide
IUPAC NAME: N-(4-nitrophenyl)acetamide
SYSTEMATIC NAME: N-(4-nitrophenyl)ethanamide
MOLECULAR FORMULA: C8H8N2O3
MOLECULAR WEIGHT: 180.16072
SMILES: CC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]
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Product OPENEYE NAME: 1-chloro-4-isocyanato-benzene
CAS Name: 1-chloro-4-isocyanatobenzene
IUPAC NAME: 1-chloro-4-isocyanatobenzene
SYSTEMATIC NAME: 1-chloranyl-4-isocyanato-benzene
MOLECULAR FORMULA: C7H4ClNO
MOLECULAR WEIGHT: 153.56576
SMILES: C1=CC(=CC=C1N=C=O)Cl
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Product OPENEYE NAME: 4-butylaniline
CAS Name: 4-butylaniline
IUPAC NAME: 4-butylaniline
SYSTEMATIC NAME: 4-butylaniline
MOLECULAR FORMULA: C10H15N
MOLECULAR WEIGHT: 149.2328
SMILES: CCCCC1=CC=C(C=C1)N
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Product OPENEYE NAME: (4-methoxyphenyl)methyl acetate
CAS Name: acetic acid (4-methoxyphenyl)methyl ester
IUPAC NAME: (4-methoxyphenyl)methyl acetate
SYSTEMATIC NAME: (4-methoxyphenyl)methyl ethanoate
MOLECULAR FORMULA: C10H12O3
MOLECULAR WEIGHT: 180.20048
SMILES: CC(=O)OCC1=CC=C(C=C1)OC
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Product OPENEYE NAME: 3-(4-chlorophenoxy)propane-1,2-diol
CAS Name: 3-(4-chlorophenoxy)propane-1,2-diol
IUPAC NAME: 3-(4-chlorophenoxy)propane-1,2-diol
SYSTEMATIC NAME: 3-(4-chloranylphenoxy)propane-1,2-diol
MOLECULAR FORMULA: C9H11ClO3
MOLECULAR WEIGHT: 202.63484
SMILES: C1=CC(=CC=C1OCC(CO)O)Cl
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Product OPENEYE NAME: 2-(4-nitrophenyl)ethyl acetate
CAS Name: acetic acid 2-(4-nitrophenyl)ethyl ester
IUPAC NAME: 2-(4-nitrophenyl)ethyl acetate
SYSTEMATIC NAME: 2-(4-nitrophenyl)ethyl ethanoate
MOLECULAR FORMULA: C10H11NO4
MOLECULAR WEIGHT: 209.19864
SMILES: CC(=O)OCCC1=CC=C(C=C1)[N+](=O)[O-]
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Product OPENEYE NAME: 2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 4-(butylamino)benzoate
CAS Name: 4-(butylamino)benzoic acid 2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl ester
IUPAC NAME: 2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 4-(butylamino)benzoate
SYSTEMATIC NAME: 2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 4-(butylamino)benzoate
MOLECULAR FORMULA: C30H53NO11
MOLECULAR WEIGHT: 603.74192
SMILES: CCCCNC1=CC=C(C=C1)C(=O)OCCOCCOCCOCCOCCOCCOCCOCCOCCOC
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Product OPENEYE NAME: 2-(4-nonylphenoxy)ethanol
CAS Name: 2-(4-nonylphenoxy)ethanol
IUPAC NAME: 2-(4-nonylphenoxy)ethanol
SYSTEMATIC NAME: 2-(4-nonylphenoxy)ethanol
MOLECULAR FORMULA: C17H28O2
MOLECULAR WEIGHT: 264.40302
SMILES: CCCCCCCCCC1=CC=C(C=C1)OCCO
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Product OPENEYE NAME: 4-dodecylaniline
CAS Name: 4-dodecylaniline
IUPAC NAME: 4-dodecylaniline
SYSTEMATIC NAME: 4-dodecylaniline
MOLECULAR FORMULA: C18H31N
MOLECULAR WEIGHT: 261.44544
SMILES: CCCCCCCCCCCCC1=CC=C(C=C1)N
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Product OPENEYE NAME: 1-methoxy-4-propyl-benzene
CAS Name: 1-methoxy-4-propylbenzene
IUPAC NAME: 1-methoxy-4-propylbenzene
SYSTEMATIC NAME: 1-methoxy-4-propyl-benzene
MOLECULAR FORMULA: C10H14O
MOLECULAR WEIGHT: 150.21756
SMILES: CCCC1=CC=C(C=C1)OC
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Product OPENEYE NAME: 1-methoxy-4-prop-1-enyl-benzene
CAS Name: 1-methoxy-4-prop-1-enylbenzene
IUPAC NAME: 1-methoxy-4-prop-1-enylbenzene
SYSTEMATIC NAME: 1-methoxy-4-prop-1-enyl-benzene
MOLECULAR FORMULA: C10H12O
MOLECULAR WEIGHT: 148.20168
SMILES: CC=CC1=CC=C(C=C1)OC
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Product OPENEYE NAME: 5-butyltetrahydrofuran-2-one
CAS Name: 5-butyl-2-oxolanone
IUPAC NAME: 5-butyloxolan-2-one
SYSTEMATIC NAME: 5-butyloxolan-2-one
MOLECULAR FORMULA: C8H14O2
MOLECULAR WEIGHT: 142.19556
SMILES: CCCCC1CCC(=O)O1
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Product OPENEYE NAME: butylbenzene
CAS Name: butylbenzene
IUPAC NAME: butylbenzene
SYSTEMATIC NAME: butylbenzene
MOLECULAR FORMULA: C10H14
MOLECULAR WEIGHT: 134.21816
SMILES: CCCCC1=CC=CC=C1
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Product OPENEYE NAME: 3-chloropropylbenzene
CAS Name: 3-chloropropylbenzene
IUPAC NAME: 3-chloropropylbenzene
SYSTEMATIC NAME: 3-chloranylpropylbenzene
MOLECULAR FORMULA: C9H11Cl
MOLECULAR WEIGHT: 154.63664
SMILES: C1=CC=C(C=C1)CCCCl
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Product OPENEYE NAME: 3-phenylpropanal
CAS Name: 3-phenylpropanal
IUPAC NAME: 3-phenylpropanal
SYSTEMATIC NAME: 3-phenylpropanal
MOLECULAR FORMULA: C9H10O
MOLECULAR WEIGHT: 134.1751
SMILES: C1=CC=C(C=C1)CCC=O
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Product OPENEYE NAME: benzyl formate
CAS Name: formic acid (phenylmethyl) ester
IUPAC NAME: benzyl formate
SYSTEMATIC NAME: (phenylmethyl) methanoate
MOLECULAR FORMULA: C8H8O2
MOLECULAR WEIGHT: 136.14792
SMILES: C1=CC=C(C=C1)COC=O
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Product OPENEYE NAME: octadec-9-enoic acid; phenylmercury
CAS Name: 9-octadecenoic acid; phenylmercury
IUPAC NAME: octadec-9-enoic acid; phenylmercury
SYSTEMATIC NAME: octadec-9-enoic acid; phenylmercury
MOLECULAR FORMULA: C24H39HgO2
MOLECULAR WEIGHT: 560.15526
SMILES: CCCCCCCCC=CCCCCCCCC(=O)O.C1=CC=C(C=C1)[Hg]
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Product OPENEYE NAME: 5-pentyltetrahydrofuran-2-one
CAS Name: 5-pentyl-2-oxolanone
IUPAC NAME: 5-pentyloxolan-2-one
SYSTEMATIC NAME: 5-pentyloxolan-2-one
MOLECULAR FORMULA: C9H16O2
MOLECULAR WEIGHT: 156.22214
SMILES: CCCCCC1CCC(=O)O1
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Product OPENEYE NAME: 2-phenylethyl formate
CAS Name: formic acid 2-phenylethyl ester
IUPAC NAME: 2-phenylethyl formate
SYSTEMATIC NAME: 2-phenylethyl methanoate
MOLECULAR FORMULA: C9H10O2
MOLECULAR WEIGHT: 150.1745
SMILES: C1=CC=C(C=C1)CCOC=O
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Product OPENEYE NAME: cinnamyl formate
CAS Name: formic acid 3-phenylprop-2-enyl ester
IUPAC NAME: 3-phenylprop-2-enyl formate
SYSTEMATIC NAME: 3-phenylprop-2-enyl methanoate
MOLECULAR FORMULA: C10H10O2
MOLECULAR WEIGHT: 162.1852
SMILES: C1=CC=C(C=C1)C=CCOC=O
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Product OPENEYE NAME: 2-phenoxyethoxybenzene
CAS Name: 2-phenoxyethoxybenzene
IUPAC NAME: 2-phenoxyethoxybenzene
SYSTEMATIC NAME: 2-phenoxyethoxybenzene
MOLECULAR FORMULA: C14H14O2
MOLECULAR WEIGHT: 214.25976
SMILES: C1=CC=C(C=C1)OCCOC2=CC=CC=C2
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Product OPENEYE NAME: 5-heptyltetrahydrofuran-2-one
CAS Name: 5-heptyl-2-oxolanone
IUPAC NAME: 5-heptyloxolan-2-one
SYSTEMATIC NAME: 5-heptyloxolan-2-one
MOLECULAR FORMULA: C11H20O2
MOLECULAR WEIGHT: 184.2753
SMILES: CCCCCCCC1CCC(=O)O1
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