Product OPENEYE NAME: butanedinitrile
CAS Name: butanedinitrile
IUPAC NAME: butanedinitrile
SYSTEMATIC NAME: butanedinitrile
MOLECULAR FORMULA: C4H4N2
MOLECULAR WEIGHT: 80.08796
SMILES: C(CC#N)C#N
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Product OPENEYE NAME: pentanal
CAS Name: pentanal
IUPAC NAME: pentanal
SYSTEMATIC NAME: pentanal
MOLECULAR FORMULA: C5H10O
MOLECULAR WEIGHT: 86.1323
SMILES: CCCCC=O
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Product OPENEYE NAME: butane-1,4-diol
CAS Name: butane-1,4-diol
IUPAC NAME: butane-1,4-diol
SYSTEMATIC NAME: butane-1,4-diol
MOLECULAR FORMULA: C4H10O2
MOLECULAR WEIGHT: 90.121
SMILES: C(CCO)CO
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Product OPENEYE NAME: but-2-ene-1,4-diol
CAS Name: 2-butene-1,4-diol
IUPAC NAME: but-2-ene-1,4-diol
SYSTEMATIC NAME: but-2-ene-1,4-diol
MOLECULAR FORMULA: C4H8O2
MOLECULAR WEIGHT: 88.10512
SMILES: C(C=CCO)O
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Product OPENEYE NAME: but-2-yne-1,4-diol
CAS Name: 2-butyne-1,4-diol
IUPAC NAME: but-2-yne-1,4-diol
SYSTEMATIC NAME: but-2-yne-1,4-diol
MOLECULAR FORMULA: C4H6O2
MOLECULAR WEIGHT: 86.08924
SMILES: C(C#CCO)O
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Product OPENEYE NAME: pentane-1-thiol
CAS Name: 1-pentanethiol
IUPAC NAME: pentane-1-thiol
SYSTEMATIC NAME: pentane-1-thiol
MOLECULAR FORMULA: C5H12S
MOLECULAR WEIGHT: 104.21378
SMILES: CCCCCS
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Product OPENEYE NAME: N-methylbutan-1-amine
CAS Name: N-methyl-1-butanamine
IUPAC NAME: N-methylbutan-1-amine
SYSTEMATIC NAME: N-methylbutan-1-amine
MOLECULAR FORMULA: C5H13N
MOLECULAR WEIGHT: 87.16342
SMILES: CCCCNC
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Product OPENEYE NAME: butanal oxime
CAS Name: butanal oxime
IUPAC NAME: N-butylidenehydroxylamine
SYSTEMATIC NAME: N-butylidenehydroxylamine
MOLECULAR FORMULA: C4H9NO
MOLECULAR WEIGHT: 87.12036
SMILES: CCCC=NO
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Product OPENEYE NAME: N,N'-dimethylethane-1,2-diamine
CAS Name: N,N'-dimethylethane-1,2-diamine
IUPAC NAME: N,N'-dimethylethane-1,2-diamine
SYSTEMATIC NAME: N,N'-dimethylethane-1,2-diamine
MOLECULAR FORMULA: C4H12N2
MOLECULAR WEIGHT: 88.15148
SMILES: CNCCNC
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Product OPENEYE NAME: 1,2-dimethoxyethane
CAS Name: 1,2-dimethoxyethane
IUPAC NAME: 1,2-dimethoxyethane
SYSTEMATIC NAME: 1,2-dimethoxyethane
MOLECULAR FORMULA: C4H10O2
MOLECULAR WEIGHT: 90.121
SMILES: COCCOC
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Product OPENEYE NAME: 2-(ethylamino)ethanol
CAS Name: 2-(ethylamino)ethanol
IUPAC NAME: 2-(ethylamino)ethanol
SYSTEMATIC NAME: 2-(ethylamino)ethanol
MOLECULAR FORMULA: C4H11NO
MOLECULAR WEIGHT: 89.13624
SMILES: CCNCCO
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Product OPENEYE NAME: propyl formate
CAS Name: formic acid propyl ester
IUPAC NAME: propyl formate
SYSTEMATIC NAME: propyl methanoate
MOLECULAR FORMULA: C4H8O2
MOLECULAR WEIGHT: 88.10512
SMILES: CCCOC=O
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Product OPENEYE NAME: 1-chloro-2-vinyloxy-ethane
CAS Name: 1-chloro-2-ethenoxyethane
IUPAC NAME: 1-chloro-2-ethenoxyethane
SYSTEMATIC NAME: 1-chloranyl-2-ethenoxy-ethane
MOLECULAR FORMULA: C4H7ClO
MOLECULAR WEIGHT: 106.55078
SMILES: C=COCCCl
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Product OPENEYE NAME: 2-ethylsulfanylethanol
CAS Name: 2-(ethylthio)ethanol
IUPAC NAME: 2-ethylsulfanylethanol
SYSTEMATIC NAME: 2-ethylsulfanylethanol
MOLECULAR FORMULA: C4H10OS
MOLECULAR WEIGHT: 106.1866
SMILES: CCSCCO
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Product OPENEYE NAME: 2-ethoxyethanol
CAS Name: 2-ethoxyethanol
IUPAC NAME: 2-ethoxyethanol
SYSTEMATIC NAME: 2-ethoxyethanol
MOLECULAR FORMULA: C4H10O2
MOLECULAR WEIGHT: 90.121
SMILES: CCOCCO
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Product OPENEYE NAME: (ethyldisulfanyl)ethane
CAS Name: (ethyldisulfanyl)ethane
IUPAC NAME: (ethyldisulfanyl)ethane
SYSTEMATIC NAME: (ethyldisulfanyl)ethane
MOLECULAR FORMULA: C4H10S2
MOLECULAR WEIGHT: 122.2522
SMILES: CCSSCC
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Product OPENEYE NAME: cyclohexane
CAS Name: cyclohexane
IUPAC NAME: cyclohexane
SYSTEMATIC NAME: cyclohexane
MOLECULAR FORMULA: C6H12
MOLECULAR WEIGHT: 84.15948
SMILES: C1CCCCC1
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