Product OPENEYE NAME: methyl aziridine-1-carboxylate
CAS Name: 1-aziridinecarboxylic acid methyl ester
IUPAC NAME: methyl aziridine-1-carboxylate
SYSTEMATIC NAME: methyl aziridine-1-carboxylate
MOLECULAR FORMULA: C4H7NO2
MOLECULAR WEIGHT: 101.10388
SMILES: COC(=O)N1CC1
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Product OPENEYE NAME: ethyl aziridine-1-carboxylate
CAS Name: 1-aziridinecarboxylic acid ethyl ester
IUPAC NAME: ethyl aziridine-1-carboxylate
SYSTEMATIC NAME: ethyl aziridine-1-carboxylate
MOLECULAR FORMULA: C5H9NO2
MOLECULAR WEIGHT: 115.13046
SMILES: CCOC(=O)N1CC1
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Product OPENEYE NAME: isopropyl aziridine-1-carboxylate
CAS Name: 1-aziridinecarboxylic acid propan-2-yl ester
IUPAC NAME: propan-2-yl aziridine-1-carboxylate
SYSTEMATIC NAME: propan-2-yl aziridine-1-carboxylate
MOLECULAR FORMULA: C6H11NO2
MOLECULAR WEIGHT: 129.15704
SMILES: CC(C)OC(=O)N1CC1
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Product OPENEYE NAME: butyl aziridine-1-carboxylate
CAS Name: 1-aziridinecarboxylic acid butyl ester
IUPAC NAME: butyl aziridine-1-carboxylate
SYSTEMATIC NAME: butyl aziridine-1-carboxylate
MOLECULAR FORMULA: C7H13NO2
MOLECULAR WEIGHT: 143.18362
SMILES: CCCCOC(=O)N1CC1
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Product OPENEYE NAME: 1-chlorobut-3-en-2-ol
CAS Name: 1-chloro-3-buten-2-ol
IUPAC NAME: 1-chlorobut-3-en-2-ol
SYSTEMATIC NAME: 1-chloranylbut-3-en-2-ol
MOLECULAR FORMULA: C4H7ClO
MOLECULAR WEIGHT: 106.55078
SMILES: C=CC(CCl)O
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Product OPENEYE NAME: [3-(1-ethylpropyl)phenyl] N-methylcarbamate
CAS Name: N-methylcarbamic acid (3-pentan-3-ylphenyl) ester
IUPAC NAME: (3-pentan-3-ylphenyl) N-methylcarbamate
SYSTEMATIC NAME: (3-pentan-3-ylphenyl) N-methylcarbamate
MOLECULAR FORMULA: C13H19NO2
MOLECULAR WEIGHT: 221.29546
SMILES: CCC(CC)C1=CC(=CC=C1)OC(=O)NC
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Product OPENEYE NAME: (2,4-dichloro-5-ethyl-3-methyl-phenyl) N-methylcarbamate
CAS Name: N-methylcarbamic acid (2,4-dichloro-5-ethyl-3-methylphenyl) ester
IUPAC NAME: (2,4-dichloro-5-ethyl-3-methylphenyl) N-methylcarbamate
SYSTEMATIC NAME: [2,4-bis(chloranyl)-5-ethyl-3-methyl-phenyl] N-methylcarbamate
MOLECULAR FORMULA: C11H13Cl2NO2
MOLECULAR WEIGHT: 262.13242
SMILES: CCC1=CC(=C(C(=C1Cl)C)Cl)OC(=O)NC
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Product OPENEYE NAME: 2-(diethylamino)-N-(5-ethyl-2-methyl-phenyl)acetamide
CAS Name: 2-(diethylamino)-N-(5-ethyl-2-methylphenyl)acetamide
IUPAC NAME: 2-(diethylamino)-N-(5-ethyl-2-methylphenyl)acetamide
SYSTEMATIC NAME: 2-(diethylamino)-N-(5-ethyl-2-methyl-phenyl)ethanamide
MOLECULAR FORMULA: C15H24N2O
MOLECULAR WEIGHT: 248.36386
SMILES: CCC1=CC(=C(C=C1)C)NC(=O)CN(CC)CC
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Product OPENEYE NAME: 4-(diethylamino)-N-(5-ethyl-2-methyl-phenyl)butanamide
CAS Name: 4-(diethylamino)-N-(5-ethyl-2-methylphenyl)butanamide
IUPAC NAME: 4-(diethylamino)-N-(5-ethyl-2-methylphenyl)butanamide
SYSTEMATIC NAME: 4-(diethylamino)-N-(5-ethyl-2-methyl-phenyl)butanamide
MOLECULAR FORMULA: C17H28N2O
MOLECULAR WEIGHT: 276.41702
SMILES: CCC1=CC(=C(C=C1)C)NC(=O)CCCN(CC)CC
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Product OPENEYE NAME: (2S)-2-amino-4-hydroxy-butanoic acid
CAS Name: (2S)-2-amino-4-hydroxybutanoic acid
IUPAC NAME: (2S)-2-amino-4-hydroxybutanoic acid
SYSTEMATIC NAME: (2S)-2-azanyl-4-oxidanyl-butanoic acid
MOLECULAR FORMULA: C4H9NO3
MOLECULAR WEIGHT: 119.11916
SMILES: C(CO)[C@@H](C(=O)O)N
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Product OPENEYE NAME: 1-chloroethylbenzene
CAS Name: 1-chloroethylbenzene
IUPAC NAME: 1-chloroethylbenzene
SYSTEMATIC NAME: 1-chloroethylbenzene
MOLECULAR FORMULA: C8H9Cl
MOLECULAR WEIGHT: 140.61006
SMILES: CC(C1=CC=CC=C1)Cl
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Product OPENEYE NAME: 2-hydroxy-5-isopropyl-cyclohepta-2,4,6-trien-1-one
CAS Name: 2-hydroxy-5-propan-2-yl-1-cyclohepta-2,4,6-trienone
IUPAC NAME: 2-hydroxy-5-propan-2-ylcyclohepta-2,4,6-trien-1-one
SYSTEMATIC NAME: 2-oxidanyl-5-propan-2-yl-cyclohepta-2,4,6-trien-1-one
MOLECULAR FORMULA: C10H12O2
MOLECULAR WEIGHT: 164.20108
SMILES: CC(C)C1=CC=C(C(=O)C=C1)O
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Product OPENEYE NAME: (2R)-2-amino-3-(4-hydroxyphenyl)-2-methyl-propanoic acid
CAS Name: (2R)-2-amino-3-(4-hydroxyphenyl)-2-methylpropanoic acid
IUPAC NAME: (2R)-2-amino-3-(4-hydroxyphenyl)-2-methylpropanoic acid
SYSTEMATIC NAME: (2R)-2-azanyl-3-(4-hydroxyphenyl)-2-methyl-propanoic acid
MOLECULAR FORMULA: C10H13NO3
MOLECULAR WEIGHT: 195.21512
SMILES: C[C@@](CC1=CC=C(C=C1)O)(C(=O)O)N
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Product OPENEYE NAME: 4-methoxy-6-methyl-pyran-2-one
CAS Name: 4-methoxy-6-methyl-2-pyranone
IUPAC NAME: 4-methoxy-6-methylpyran-2-one
SYSTEMATIC NAME: 4-methoxy-6-methyl-pyran-2-one
MOLECULAR FORMULA: C7H8O3
MOLECULAR WEIGHT: 140.13662
SMILES: CC1=CC(=CC(=O)O1)OC
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Product OPENEYE NAME: N2-(4-chlorophenyl)-6-ethyl-1,3,5-triazine-2,4-diamine
CAS Name: N2-(4-chlorophenyl)-6-ethyl-1,3,5-triazine-2,4-diamine
IUPAC NAME: 2-N-(4-chlorophenyl)-6-ethyl-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: N2-(4-chlorophenyl)-6-ethyl-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C11H12ClN5
MOLECULAR WEIGHT: 249.69948
SMILES: CCC1=NC(=NC(=N1)NC2=CC=C(C=C2)Cl)N
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Product OPENEYE NAME: (4-chloro-3,5-dimethyl-phenyl) N-methylcarbamate
CAS Name: N-methylcarbamic acid (4-chloro-3,5-dimethylphenyl) ester
IUPAC NAME: (4-chloro-3,5-dimethylphenyl) N-methylcarbamate
SYSTEMATIC NAME: (4-chloranyl-3,5-dimethyl-phenyl) N-methylcarbamate
MOLECULAR FORMULA: C10H12ClNO2
MOLECULAR WEIGHT: 213.66078
SMILES: CC1=CC(=CC(=C1Cl)C)OC(=O)NC
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Product OPENEYE NAME: N2,N4-diethyl-6-methoxy-1,3,5-triazine-2,4-diamine
CAS Name: N2,N4-diethyl-6-methoxy-1,3,5-triazine-2,4-diamine
IUPAC NAME: 2-N,4-N-diethyl-6-methoxy-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: N2,N4-diethyl-6-methoxy-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C8H15N5O
MOLECULAR WEIGHT: 197.2376
SMILES: CCNC1=NC(=NC(=N1)OC)NCC
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Product OPENEYE NAME: (3-sec-butylphenyl) N-methylcarbamate
CAS Name: N-methylcarbamic acid (3-butan-2-ylphenyl) ester
IUPAC NAME: (3-butan-2-ylphenyl) N-methylcarbamate
SYSTEMATIC NAME: (3-butan-2-ylphenyl) N-methylcarbamate
MOLECULAR FORMULA: C12H17NO2
MOLECULAR WEIGHT: 207.26888
SMILES: CCC(C)C1=CC(=CC=C1)OC(=O)NC
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Product OPENEYE NAME: 2-(1H-imidazol-5-yl)-N,N-dimethyl-ethanamine
CAS Name: 2-(1H-imidazol-5-yl)-N,N-dimethylethanamine
IUPAC NAME: 2-(1H-imidazol-5-yl)-N,N-dimethylethanamine
SYSTEMATIC NAME: 2-(1H-imidazol-5-yl)-N,N-dimethyl-ethanamine
MOLECULAR FORMULA: C7H13N3
MOLECULAR WEIGHT: 139.19822
SMILES: CN(C)CCC1=CN=CN1
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Product OPENEYE NAME: azocan-2-one
CAS Name: 2-azocanone
IUPAC NAME: azocan-2-one
SYSTEMATIC NAME: azocan-2-one
MOLECULAR FORMULA: C7H13NO
MOLECULAR WEIGHT: 127.18422
SMILES: C1CCCNC(=O)CC1
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Product OPENEYE NAME: 2,6-dimethylocta-2,4,6-triene
CAS Name: 2,6-dimethylocta-2,4,6-triene
IUPAC NAME: 2,6-dimethylocta-2,4,6-triene
SYSTEMATIC NAME: 2,6-dimethylocta-2,4,6-triene
MOLECULAR FORMULA: C10H16
MOLECULAR WEIGHT: 136.23404
SMILES: CC=C(C)C=CC=C(C)C
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Product OPENEYE NAME: 4-methylpent-2-ene
CAS Name: 4-methyl-2-pentene
IUPAC NAME: 4-methylpent-2-ene
SYSTEMATIC NAME: 4-methylpent-2-ene
MOLECULAR FORMULA: C6H12
MOLECULAR WEIGHT: 84.15948
SMILES: CC=CC(C)C
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Product OPENEYE NAME: 2-nitrosoguanidine
CAS Name: 2-nitrosoguanidine
IUPAC NAME: 2-nitrosoguanidine
SYSTEMATIC NAME: 2-nitrosoguanidine
MOLECULAR FORMULA: CH4N4O
MOLECULAR WEIGHT: 88.06866
SMILES: C(=NN=O)(N)N
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