Product OPENEYE NAME: (Z)-3-(2,4-difluorophenyl)but-2-enoic acid
CAS Name: (Z)-3-(2,4-difluorophenyl)-2-butenoic acid
IUPAC NAME: (Z)-3-(2,4-difluorophenyl)but-2-enoic acid
SYSTEMATIC NAME: (Z)-3-[2,4-bis(fluoranyl)phenyl]but-2-enoic acid
MOLECULAR FORMULA: C10H8F2O2
MOLECULAR WEIGHT: 198.166126
SMILES: C/C(=C/C(=O)O)/C1=C(C=C(C=C1)F)F
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Product OPENEYE NAME: [1-carboxy-1-ethyl-2-[3-(4-fluorophenyl)-5-(7-methyl-5-bicyclo[4.2.0]octa-1(6),2,4-trienyl)imidazol-4-yl]-2-hydroxy-propyl]-hydroxy-oxo-phosphonium
CAS Name: [3-carboxy-2-[3-(4-fluorophenyl)-5-(7-methyl-5-bicyclo[4.2.0]octa-1(6),2,4-trienyl)-4-imidazolyl]-2-hydroxypentan-3-yl]-hydroxy-oxophosphonium
IUPAC NAME: [3-carboxy-2-[3-(4-fluorophenyl)-5-(7-methyl-5-bicyclo[4.2.0]octa-1(6),2,4-trienyl)imidazol-4-yl]-2-hydroxypentan-3-yl]-hydroxy-oxophosphanium
SYSTEMATIC NAME: [3-carboxy-2-[3-(4-fluorophenyl)-5-(7-methyl-5-bicyclo[4.2.0]octa-1(6),2,4-trienyl)imidazol-4-yl]-2-oxidanyl-pentan-3-yl]-oxidanyl-oxidanylidene-phosphanium
MOLECULAR FORMULA: C24H25FN2O5P+
MOLECULAR WEIGHT: 471.437864
SMILES: CCC(C(=O)O)(C(C)(C1=C(N=CN1C2=CC=C(C=C2)F)C3=C4C(CC4=CC=C3)C)O)[P+](=O)O
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Product OPENEYE NAME: 1-[bis(1-ethylsulfanylethylsulfanyl)phosphoryloxy]-1-ethylsulfanyl-ethane
CAS Name: 1-bis[1-(ethylthio)ethylthio]phosphoryloxy-1-(ethylthio)ethane
IUPAC NAME: 1-[bis(1-ethylsulfanylethylsulfanyl)phosphoryloxy]-1-ethylsulfanylethane
SYSTEMATIC NAME: 1-[bis(1-ethylsulfanylethylsulfanyl)phosphoryloxy]-1-ethylsulfanyl-ethane
MOLECULAR FORMULA: C12H27O2PS5
MOLECULAR WEIGHT: 394.640341
SMILES: CCSC(C)OP(=O)(SC(C)SCC)SC(C)SCC
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Product OPENEYE NAME: methyl N-carbamoyl-N-[1-methyl-2-(2-methylanilino)-2-oxo-ethyl]carbamate
CAS Name: N-carbamoyl-N-[1-(2-methylanilino)-1-oxopropan-2-yl]carbamic acid methyl ester
IUPAC NAME: methyl N-carbamoyl-N-[1-(2-methylanilino)-1-oxopropan-2-yl]carbamate
SYSTEMATIC NAME: methyl N-aminocarbonyl-N-[1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl]carbamate
MOLECULAR FORMULA: C13H17N3O4
MOLECULAR WEIGHT: 279.29178
SMILES: CC1=CC=CC=C1NC(=O)C(C)N(C(=O)N)C(=O)OC
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Product OPENEYE NAME: [hydroxy-[3,4,5-trihydroxy-5-(6-methoxy-2-propylsulfanyl-purin-9-yl)tetrahydrofuran-2-yl]methyl] dihydrogen phosphate
CAS Name: [hydroxy-[3,4,5-trihydroxy-5-[6-methoxy-2-(propylthio)-9-purinyl]-2-oxolanyl]methyl] dihydrogen phosphate
IUPAC NAME: [hydroxy-[3,4,5-trihydroxy-5-(6-methoxy-2-propylsulfanylpurin-9-yl)oxolan-2-yl]methyl] dihydrogen phosphate
SYSTEMATIC NAME: [[5-(6-methoxy-2-propylsulfanyl-purin-9-yl)-3,4,5-tris(oxidanyl)oxolan-2-yl]-oxidanyl-methyl] dihydrogen phosphate
MOLECULAR FORMULA: C14H21N4O10PS
MOLECULAR WEIGHT: 468.376101
SMILES: CCCSC1=NC2=C(C(=N1)OC)N=CN2C3(C(C(C(O3)C(O)OP(=O)(O)O)O)O)O
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Product OPENEYE NAME: 1-oxo-4-[(E)-tetradec-9-enyl]-2H-thiophen-5-one
CAS Name: 1-oxo-4-[(E)-tetradec-9-enyl]-2H-thiophen-5-one
IUPAC NAME: 1-oxo-4-[(E)-tetradec-9-enyl]-2H-thiophen-5-one
SYSTEMATIC NAME: 1-oxidanylidene-4-[(E)-tetradec-9-enyl]-2H-thiophen-5-one
MOLECULAR FORMULA: C18H30O2S
MOLECULAR WEIGHT: 310.4946
SMILES: CCCC/C=C/CCCCCCCCC1=CCS(=O)C1=O
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Product OPENEYE NAME: 4-(2-benzyloxyacetyl)-2H-furan-5-one
CAS Name: 4-(1-oxo-2-phenylmethoxyethyl)-2H-furan-5-one
IUPAC NAME: 4-(2-phenylmethoxyacetyl)-2H-furan-5-one
SYSTEMATIC NAME: 4-(2-phenylmethoxyethanoyl)-2H-furan-5-one
MOLECULAR FORMULA: C13H12O4
MOLECULAR WEIGHT: 232.23198
SMILES: C1C=C(C(=O)O1)C(=O)COCC2=CC=CC=C2
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Product OPENEYE NAME: 3-cyclopropyl-4-octyl-2-[(2-pentylcyclopropyl)methyl]-2H-furan-5-one
CAS Name: 3-cyclopropyl-4-octyl-2-[(2-pentylcyclopropyl)methyl]-2H-furan-5-one
IUPAC NAME: 3-cyclopropyl-4-octyl-2-[(2-pentylcyclopropyl)methyl]-2H-furan-5-one
SYSTEMATIC NAME: 3-cyclopropyl-4-octyl-2-[(2-pentylcyclopropyl)methyl]-2H-furan-5-one
MOLECULAR FORMULA: C24H40O2
MOLECULAR WEIGHT: 360.5732
SMILES: CCCCCCCCC1=C(C(OC1=O)CC2CC2CCCCC)C3CC3
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Product OPENEYE NAME: 3-(4-chlorophenyl)-4-(6-methoxy-6-phenoxy-hexanoyl)-2H-furan-5-one
CAS Name: 3-(4-chlorophenyl)-4-(6-methoxy-1-oxo-6-phenoxyhexyl)-2H-furan-5-one
IUPAC NAME: 3-(4-chlorophenyl)-4-(6-methoxy-6-phenoxyhexanoyl)-2H-furan-5-one
SYSTEMATIC NAME: 3-(4-chlorophenyl)-4-(6-methoxy-6-phenoxy-hexanoyl)-2H-furan-5-one
MOLECULAR FORMULA: C23H23ClO5
MOLECULAR WEIGHT: 414.87872
SMILES: COC(CCCCC(=O)C1=C(COC1=O)C2=CC=C(C=C2)Cl)OC3=CC=CC=C3
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Product OPENEYE NAME: 1-oxo-4-[2-(2-pentylcyclopropyl)ethyl]-2H-thiophen-5-one
CAS Name: 1-oxo-4-[2-(2-pentylcyclopropyl)ethyl]-2H-thiophen-5-one
IUPAC NAME: 1-oxo-4-[2-(2-pentylcyclopropyl)ethyl]-2H-thiophen-5-one
SYSTEMATIC NAME: 1-oxidanylidene-4-[2-(2-pentylcyclopropyl)ethyl]-2H-thiophen-5-one
MOLECULAR FORMULA: C14H22O2S
MOLECULAR WEIGHT: 254.38828
SMILES: CCCCCC1CC1CCC2=CCS(=O)C2=O
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Product OPENEYE NAME: 4-[8-(2-octylcyclopropyl)octanoyl]-2H-thiophen-5-one
CAS Name: 4-[8-(2-octylcyclopropyl)-1-oxooctyl]-2H-thiophen-5-one
IUPAC NAME: 4-[8-(2-octylcyclopropyl)octanoyl]-2H-thiophen-5-one
SYSTEMATIC NAME: 4-[8-(2-octylcyclopropyl)octanoyl]-2H-thiophen-5-one
MOLECULAR FORMULA: C23H38O2S
MOLECULAR WEIGHT: 378.61162
SMILES: CCCCCCCCC1CC1CCCCCCCC(=O)C2=CCSC2=O
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Product OPENEYE NAME: 4-[8-(2-butylcyclopropyl)octanoyl]-2H-furan-5-one
CAS Name: 4-[8-(2-butylcyclopropyl)-1-oxooctyl]-2H-furan-5-one
IUPAC NAME: 4-[8-(2-butylcyclopropyl)octanoyl]-2H-furan-5-one
SYSTEMATIC NAME: 4-[8-(2-butylcyclopropyl)octanoyl]-2H-furan-5-one
MOLECULAR FORMULA: C19H30O3
MOLECULAR WEIGHT: 306.4397
SMILES: CCCCC1CC1CCCCCCCC(=O)C2=CCOC2=O
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Product OPENEYE NAME: 4-[(E)-octadec-9-enyl]-1-oxo-2H-thiophen-5-one
CAS Name: 4-[(E)-octadec-9-enyl]-1-oxo-2H-thiophen-5-one
IUPAC NAME: 4-[(E)-octadec-9-enyl]-1-oxo-2H-thiophen-5-one
SYSTEMATIC NAME: 4-[(E)-octadec-9-enyl]-1-oxidanylidene-2H-thiophen-5-one
MOLECULAR FORMULA: C22H38O2S
MOLECULAR WEIGHT: 366.60092
SMILES: CCCCCCCC/C=C/CCCCCCCCC1=CCS(=O)C1=O
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Product OPENEYE NAME: 5-hydroxy-4-[(E)-3-(3-nitrophenyl)prop-2-enoyl]furan-3-one
CAS Name: 5-hydroxy-4-[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]-3-furanone
IUPAC NAME: 5-hydroxy-4-[(E)-3-(3-nitrophenyl)prop-2-enoyl]furan-3-one
SYSTEMATIC NAME: 4-[(E)-3-(3-nitrophenyl)prop-2-enoyl]-5-oxidanyl-furan-3-one
MOLECULAR FORMULA: C13H9NO6
MOLECULAR WEIGHT: 275.21366
SMILES: C1C(=O)C(=C(O1)O)C(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-]
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Product OPENEYE NAME: 2-(4-chlorophenoxy)-5-hydroxy-4-pentanoyl-thiophen-3-one
CAS Name: 2-(4-chlorophenoxy)-5-hydroxy-4-(1-oxopentyl)-3-thiophenone
IUPAC NAME: 2-(4-chlorophenoxy)-5-hydroxy-4-pentanoylthiophen-3-one
SYSTEMATIC NAME: 2-(4-chloranylphenoxy)-5-oxidanyl-4-pentanoyl-thiophen-3-one
MOLECULAR FORMULA: C15H15ClO4S
MOLECULAR WEIGHT: 326.7952
SMILES: CCCCC(=O)C1=C(SC(C1=O)OC2=CC=C(C=C2)Cl)O
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Product OPENEYE NAME: 4-[(E)-octadec-6-enyl]-1-oxo-2H-thiophen-5-one
CAS Name: 4-[(E)-octadec-6-enyl]-1-oxo-2H-thiophen-5-one
IUPAC NAME: 4-[(E)-octadec-6-enyl]-1-oxo-2H-thiophen-5-one
SYSTEMATIC NAME: 4-[(E)-octadec-6-enyl]-1-oxidanylidene-2H-thiophen-5-one
MOLECULAR FORMULA: C22H38O2S
MOLECULAR WEIGHT: 366.60092
SMILES: CCCCCCCCCCC/C=C/CCCCCC1=CCS(=O)C1=O
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Product OPENEYE NAME: 1-[(2Z)-3,7-dimethylocta-2,6-dienoxy]pentan-2-ol
CAS Name: 1-[(2Z)-3,7-dimethylocta-2,6-dienoxy]-2-pentanol
IUPAC NAME: 1-[(2Z)-3,7-dimethylocta-2,6-dienoxy]pentan-2-ol
SYSTEMATIC NAME: 1-[(2Z)-3,7-dimethylocta-2,6-dienoxy]pentan-2-ol
MOLECULAR FORMULA: C15H28O2
MOLECULAR WEIGHT: 240.38162
SMILES: CCCC(COC/C=C(/C)\CCC=C(C)C)O
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Product OPENEYE NAME: 4-[(6E,9E,12E)-octadeca-6,9,12-trienyl]-1-oxo-2H-thiophen-5-one
CAS Name: 4-[(6E,9E,12E)-octadeca-6,9,12-trienyl]-1-oxo-2H-thiophen-5-one
IUPAC NAME: 4-[(6E,9E,12E)-octadeca-6,9,12-trienyl]-1-oxo-2H-thiophen-5-one
SYSTEMATIC NAME: 4-[(6E,9E,12E)-octadeca-6,9,12-trienyl]-1-oxidanylidene-2H-thiophen-5-one
MOLECULAR FORMULA: C22H34O2S
MOLECULAR WEIGHT: 362.56916
SMILES: CCCCC/C=C/C/C=C/C/C=C/CCCCCC1=CCS(=O)C1=O
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Product OPENEYE NAME: (Z)-1-[tert-butyl(dimethyl)silyl]oxypent-1-ene-1,2-diol
CAS Name: (Z)-1-[tert-butyl(dimethyl)silyl]oxy-1-pentene-1,2-diol
IUPAC NAME: (Z)-1-[tert-butyl(dimethyl)silyl]oxypent-1-ene-1,2-diol
SYSTEMATIC NAME: (Z)-1-[tert-butyl(dimethyl)silyl]oxypent-1-ene-1,2-diol
MOLECULAR FORMULA: C11H24O3Si
MOLECULAR WEIGHT: 232.39196
SMILES: CCC/C(=C(\O)/O[Si](C)(C)C(C)(C)C)/O
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