Product OPENEYE NAME: chloro(dinitro)methane
CAS Name: chloro(dinitro)methane
IUPAC NAME: chloro(dinitro)methane
SYSTEMATIC NAME: chloranyl(dinitro)methane
MOLECULAR FORMULA: CHClN2O4
MOLECULAR WEIGHT: 140.48264
SMILES: C([N+](=O)[O-])([N+](=O)[O-])Cl
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Product OPENEYE NAME: 2,3,4-trimethylhexane
CAS Name: 2,3,4-trimethylhexane
IUPAC NAME: 2,3,4-trimethylhexane
SYSTEMATIC NAME: 2,3,4-trimethylhexane
MOLECULAR FORMULA: C9H20
MOLECULAR WEIGHT: 128.2551
SMILES: CCC(C)C(C)C(C)C
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Product OPENEYE NAME: 3,4-dimethylheptane
CAS Name: 3,4-dimethylheptane
IUPAC NAME: 3,4-dimethylheptane
SYSTEMATIC NAME: 3,4-dimethylheptane
MOLECULAR FORMULA: C9H20
MOLECULAR WEIGHT: 128.2551
SMILES: CCCC(C)C(C)CC
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Product OPENEYE NAME: (2S)-2-amino-3-[(2R)-2-amino-2-carboxy-ethyl]sulfanyl-propanoic acid
CAS Name: (2S)-2-amino-3-[[(2R)-2-amino-2-carboxyethyl]thio]propanoic acid
IUPAC NAME: (2S)-2-amino-3-[(2R)-2-amino-2-carboxyethyl]sulfanylpropanoic acid
SYSTEMATIC NAME: (2S)-2-azanyl-3-[(2R)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]sulfanyl-propanoic acid
MOLECULAR FORMULA: C6H12N2O4S
MOLECULAR WEIGHT: 208.23548
SMILES: C([C@H](C(=O)O)N)SC[C@@H](C(=O)O)N
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Product OPENEYE NAME: methyl prop-2-ynoate
CAS Name: 2-propynoic acid methyl ester
IUPAC NAME: methyl prop-2-ynoate
SYSTEMATIC NAME: methyl prop-2-ynoate
MOLECULAR FORMULA: C4H4O2
MOLECULAR WEIGHT: 84.07336
SMILES: COC(=O)C#C
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Product OPENEYE NAME: N-[2-[acetyl(nitro)amino]ethyl]-N-nitro-acetamide
CAS Name: N-[2-[acetyl(nitro)amino]ethyl]-N-nitroacetamide
IUPAC NAME: N-[2-[acetyl(nitro)amino]ethyl]-N-nitroacetamide
SYSTEMATIC NAME: N-[2-[ethanoyl(nitro)amino]ethyl]-N-nitro-ethanamide
MOLECULAR FORMULA: C6H10N4O6
MOLECULAR WEIGHT: 234.1668
SMILES: CC(=O)N(CCN(C(=O)C)[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 2-amino-3-cyano-propanoic acid
CAS Name: 2-amino-3-cyanopropanoic acid
IUPAC NAME: 2-amino-3-cyanopropanoic acid
SYSTEMATIC NAME: 2-azanyl-3-cyano-propanoic acid
MOLECULAR FORMULA: C4H6N2O2
MOLECULAR WEIGHT: 114.10264
SMILES: C(C#N)C(C(=O)O)N
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Product OPENEYE NAME: 2-hydroxypropyl 2-methylprop-2-enoate
CAS Name: 2-methyl-2-propenoic acid 2-hydroxypropyl ester
IUPAC NAME: 2-hydroxypropyl 2-methylprop-2-enoate
SYSTEMATIC NAME: 2-oxidanylpropyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C7H12O3
MOLECULAR WEIGHT: 144.16838
SMILES: CC(COC(=O)C(=C)C)O
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Product OPENEYE NAME: 2-[2-[2-[bis(carboxymethyl)amino]ethoxy]ethyl-(carboxymethyl)amino]acetic acid
CAS Name: 2-[2-[2-[bis(carboxymethyl)amino]ethoxy]ethyl-(carboxymethyl)amino]acetic acid
IUPAC NAME: 2-[2-[2-[bis(carboxymethyl)amino]ethoxy]ethyl-(carboxymethyl)amino]acetic acid
SYSTEMATIC NAME: 2-[2-[2-[bis(2-hydroxy-2-oxoethyl)amino]ethoxy]ethyl-(2-hydroxy-2-oxoethyl)amino]ethanoic acid
MOLECULAR FORMULA: C12H20N2O9
MOLECULAR WEIGHT: 336.2952
SMILES: C(COCCN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O
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Product OPENEYE NAME: 2-(1-hexylheptoxy)ethanol
CAS Name: 2-tridecan-7-yloxyethanol
IUPAC NAME: 2-tridecan-7-yloxyethanol
SYSTEMATIC NAME: 2-tridecan-7-yloxyethanol
MOLECULAR FORMULA: C15H32O2
MOLECULAR WEIGHT: 244.41338
SMILES: CCCCCCC(CCCCCC)OCCO
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Product OPENEYE NAME: N,N-dibutylnitrous amide
CAS Name: N,N-dibutylnitrous amide
IUPAC NAME: N,N-dibutylnitrous amide
SYSTEMATIC NAME: N,N-dibutylnitrous amide
MOLECULAR FORMULA: C8H18N2O
MOLECULAR WEIGHT: 158.24132
SMILES: CCCCN(CCCC)N=O
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Product OPENEYE NAME: N-(hydroxymethyl)prop-2-enamide
CAS Name: N-(hydroxymethyl)-2-propenamide
IUPAC NAME: N-(hydroxymethyl)prop-2-enamide
SYSTEMATIC NAME: N-(hydroxymethyl)prop-2-enamide
MOLECULAR FORMULA: C4H7NO2
MOLECULAR WEIGHT: 101.10388
SMILES: C=CC(=O)NCO
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Product OPENEYE NAME: sec-butyl nitrite
CAS Name: nitrous acid butan-2-yl ester
IUPAC NAME: butan-2-yl nitrite
SYSTEMATIC NAME: butan-2-yl nitrite
MOLECULAR FORMULA: C4H9NO2
MOLECULAR WEIGHT: 103.11976
SMILES: CCC(C)ON=O
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Product OPENEYE NAME: N-methyl-N-propyl-nitrous amide
CAS Name: N-methyl-N-propylnitrous amide
IUPAC NAME: N-methyl-N-propylnitrous amide
SYSTEMATIC NAME: N-methyl-N-propyl-nitrous amide
MOLECULAR FORMULA: C4H10N2O
MOLECULAR WEIGHT: 102.135
SMILES: CCCN(C)N=O
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Product OPENEYE NAME: methyl 3-methylbut-2-enoate
CAS Name: 3-methyl-2-butenoic acid methyl ester
IUPAC NAME: methyl 3-methylbut-2-enoate
SYSTEMATIC NAME: methyl 3-methylbut-2-enoate
MOLECULAR FORMULA: C6H10O2
MOLECULAR WEIGHT: 114.1424
SMILES: CC(=CC(=O)OC)C
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Product OPENEYE NAME: 1-(diaminomethylene)-2-isobutyl-guanidine hydrochloride
CAS Name: 1-(diaminomethylidene)-2-(2-methylpropyl)guanidine hydrochloride
IUPAC NAME: 1-(diaminomethylidene)-2-(2-methylpropyl)guanidine hydrochloride
SYSTEMATIC NAME: 1-[bis(azanyl)methylidene]-2-(2-methylpropyl)guanidine hydrochloride
MOLECULAR FORMULA: C6H16ClN5
MOLECULAR WEIGHT: 193.67774
SMILES: CC(C)CN=C(N)N=C(N)N.Cl
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Product OPENEYE NAME: 1-(diaminomethylene)-2-isobutyl-guanidine
CAS Name: 1-(diaminomethylidene)-2-(2-methylpropyl)guanidine
IUPAC NAME: 1-(diaminomethylidene)-2-(2-methylpropyl)guanidine
SYSTEMATIC NAME: 1-[bis(azanyl)methylidene]-2-(2-methylpropyl)guanidine
MOLECULAR FORMULA: C6H15N5
MOLECULAR WEIGHT: 157.2168
SMILES: CC(C)CN=C(N)N=C(N)N
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