Product OPENEYE NAME: benzyl-[2-[bis(2-chloroethyl)ammonio]ethyl]-methyl-ammonium dichloride
CAS Name: bis(2-chloroethyl)-[2-[methyl-(phenylmethyl)ammonio]ethyl]ammonium dichloride
IUPAC NAME: benzyl-[2-[bis(2-chloroethyl)azaniumyl]ethyl]-methylazanium dichloride
SYSTEMATIC NAME: bis(2-chloroethyl)-[2-[methyl-(phenylmethyl)azaniumyl]ethyl]azanium dichloride
MOLECULAR FORMULA: C14H24Cl4N2
MOLECULAR WEIGHT: 362.16576
SMILES: C[NH+](CC[NH+](CCCl)CCCl)CC1=CC=CC=C1.[Cl-].[Cl-]
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Product OPENEYE NAME: N-benzyl-N',N'-bis(2-chloroethyl)-N-methyl-ethane-1,2-diamine
CAS Name: N',N'-bis(2-chloroethyl)-N-methyl-N-(phenylmethyl)ethane-1,2-diamine
IUPAC NAME: N-benzyl-N',N'-bis(2-chloroethyl)-N-methylethane-1,2-diamine
SYSTEMATIC NAME: N',N'-bis(2-chloroethyl)-N-methyl-N-(phenylmethyl)ethane-1,2-diamine
MOLECULAR FORMULA: C14H22Cl2N2
MOLECULAR WEIGHT: 289.24388
SMILES: CN(CCN(CCCl)CCCl)CC1=CC=CC=C1
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Product OPENEYE NAME: 2-methyloctane
CAS Name: 2-methyloctane
IUPAC NAME: 2-methyloctane
SYSTEMATIC NAME: 2-methyloctane
MOLECULAR FORMULA: C9H20
MOLECULAR WEIGHT: 128.2551
SMILES: CCCCCCC(C)C
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Product OPENEYE NAME: 1-chloroallene
CAS Name: 1-chloropropa-1,2-diene
IUPAC NAME: 1-chloropropa-1,2-diene
SYSTEMATIC NAME: 1-chloranylpropa-1,2-diene
MOLECULAR FORMULA: C3H3Cl
MOLECULAR WEIGHT: 74.50892
SMILES: C=C=CCl
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Product OPENEYE NAME: 1-amino-4-chloro-2-methyl-anthracene-9,10-dione
CAS Name: 1-amino-4-chloro-2-methylanthracene-9,10-dione
IUPAC NAME: 1-amino-4-chloro-2-methylanthracene-9,10-dione
SYSTEMATIC NAME: 1-azanyl-4-chloranyl-2-methyl-anthracene-9,10-dione
MOLECULAR FORMULA: C15H10ClNO2
MOLECULAR WEIGHT: 271.6984
SMILES: CC1=CC(=C2C(=C1N)C(=O)C3=CC=CC=C3C2=O)Cl
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Product OPENEYE NAME: 2-hexylphenol
CAS Name: 2-hexylphenol
IUPAC NAME: 2-hexylphenol
SYSTEMATIC NAME: 2-hexylphenol
MOLECULAR FORMULA: C12H18O
MOLECULAR WEIGHT: 178.27072
SMILES: CCCCCCC1=CC=CC=C1O
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Product OPENEYE NAME: ammonium N,N-dimethylcarbamodithioate
CAS Name: ammonium N,N-dimethylcarbamodithioate
IUPAC NAME: azanium N,N-dimethylcarbamodithioate
SYSTEMATIC NAME: azanium N,N-dimethylcarbamodithioate
MOLECULAR FORMULA: C3H10N2S2
MOLECULAR WEIGHT: 138.2549
SMILES: CN(C)C(=S)[S-].[NH4+]
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Product OPENEYE NAME: zirconium acetate
CAS Name: zirconium acetate
IUPAC NAME: zirconium acetate
SYSTEMATIC NAME: zirconium ethanoate
MOLECULAR FORMULA: C2H3O2Zr-
MOLECULAR WEIGHT: 150.26802
SMILES: CC(=O)[O-].[Zr]
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Product OPENEYE NAME: 4-isopropyl-3-methyl-phenol
CAS Name: 3-methyl-4-propan-2-ylphenol
IUPAC NAME: 3-methyl-4-propan-2-ylphenol
SYSTEMATIC NAME: 3-methyl-4-propan-2-yl-phenol
MOLECULAR FORMULA: C10H14O
MOLECULAR WEIGHT: 150.21756
SMILES: CC1=C(C=CC(=C1)O)C(C)C
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Product OPENEYE NAME: 2-isopropyl-6-methyl-phenol
CAS Name: 2-methyl-6-propan-2-ylphenol
IUPAC NAME: 2-methyl-6-propan-2-ylphenol
SYSTEMATIC NAME: 2-methyl-6-propan-2-yl-phenol
MOLECULAR FORMULA: C10H14O
MOLECULAR WEIGHT: 150.21756
SMILES: CC1=C(C(=CC=C1)C(C)C)O
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Product OPENEYE NAME: [(4S)-4-amino-4-carboxy-butyl]ammonium; (2S)-2-amino-4-hydroxy-4-oxo-butanoate
CAS Name: [(4S)-4-amino-4-carboxybutyl]ammonium; (2S)-2-amino-4-hydroxy-4-oxobutanoate
IUPAC NAME: [(4S)-4-amino-4-carboxybutyl]azanium; (2S)-2-amino-4-hydroxy-4-oxobutanoate
SYSTEMATIC NAME: (2S)-2-azanyl-4-oxidanyl-4-oxidanylidene-butanoate; [(4S)-4-azanyl-5-oxidanyl-5-oxidanylidene-pentyl]azanium
MOLECULAR FORMULA: C9H19N3O6
MOLECULAR WEIGHT: 265.26366
SMILES: C(C[C@@H](C(=O)O)N)C[NH3+].C([C@@H](C(=O)[O-])N)C(=O)O
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Product OPENEYE NAME: 3-(2-carboxyethylsulfanylmethylsulfanyl)propanoic acid; dibutyltin
CAS Name: 3-[(2-carboxyethylthio)methylthio]propanoic acid; dibutyltin
IUPAC NAME: 3-(2-carboxyethylsulfanylmethylsulfanyl)propanoic acid; dibutyltin
SYSTEMATIC NAME: dibutyltin; 3-(3-hydroxy-3-oxopropylsulfanylmethylsulfanyl)propanoic acid
MOLECULAR FORMULA: C15H30O4S2Sn
MOLECULAR WEIGHT: 457.2363
SMILES: CCCC[Sn]CCCC.C(CSCSCCC(=O)O)C(=O)O
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Product OPENEYE NAME: 3-(2-carboxyethylsulfanylmethylsulfanyl)propanoic acid
CAS Name: 3-[(2-carboxyethylthio)methylthio]propanoic acid
IUPAC NAME: 3-(2-carboxyethylsulfanylmethylsulfanyl)propanoic acid
SYSTEMATIC NAME: 3-(3-hydroxy-3-oxopropylsulfanylmethylsulfanyl)propanoic acid
MOLECULAR FORMULA: C7H12O4S2
MOLECULAR WEIGHT: 224.29778
SMILES: C(CSCSCCC(=O)O)C(=O)O
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Product OPENEYE NAME: 6-butyl-1,3,5-triazine-2,4-diamine
CAS Name: 6-butyl-1,3,5-triazine-2,4-diamine
IUPAC NAME: 6-butyl-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: 6-butyl-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C7H13N5
MOLECULAR WEIGHT: 167.21162
SMILES: CCCCC1=NC(=NC(=N1)N)N
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Product OPENEYE NAME: 2,3-dibromobut-2-ene-1,4-diol
CAS Name: 2,3-dibromo-2-butene-1,4-diol
IUPAC NAME: 2,3-dibromobut-2-ene-1,4-diol
SYSTEMATIC NAME: 2,3-bis(bromanyl)but-2-ene-1,4-diol
MOLECULAR FORMULA: C4H6Br2O2
MOLECULAR WEIGHT: 245.89724
SMILES: C(C(=C(CO)Br)Br)O
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Product OPENEYE NAME: 2-dodecyloxirane
CAS Name: 2-dodecyloxirane
IUPAC NAME: 2-dodecyloxirane
SYSTEMATIC NAME: 2-dodecyloxirane
MOLECULAR FORMULA: C14H28O
MOLECULAR WEIGHT: 212.37152
SMILES: CCCCCCCCCCCCC1CO1
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