CAS RN: 505-01-1
CAS Name: (E)-dec-2-en-4,6-diynoic acid methyl ester
OPENEYE Name: methyl (E)-dec-2-en-4,6-diynoate
IUPAC Name: methyl (E)-dec-2-en-4,6-diynoate
SYSTEMATIC NAME: methyl (E)-dec-2-en-4,6-diynoate
MOLECULAR FORMULA: C11H12O2
MOLECULAR WEIGHT: 176.21178
SMILES: CCCC#CC#C/C=C/C(=O)OC
Structure:
CAS RN: 3788-06-5
CAS Name: (E)-dec-2-en-4,6-diynoic acid methyl ester
OPENEYE Name: methyl (E)-dec-2-en-4,6-diynoate
IUPAC Name: methyl (E)-dec-2-en-4,6-diynoate
SYSTEMATIC NAME: methyl (E)-dec-2-en-4,6-diynoate
MOLECULAR FORMULA: C11H12O2
MOLECULAR WEIGHT: 176.21178
SMILES: CCCC#CC#C/C=C/C(=O)OC
Structure:
CAS RN: 20515-19-9
CAS Name: (E)-3-pentenoic acid methyl ester
OPENEYE Name: methyl (E)-pent-3-enoate
IUPAC Name: methyl (E)-pent-3-enoate
SYSTEMATIC NAME: methyl (E)-pent-3-enoate
MOLECULAR FORMULA: C6H10O2
MOLECULAR WEIGHT: 114.1424
SMILES: C/C=C/CC(=O)OC
Structure:
CAS RN: 21731-17-9
CAS Name: (E)-3-amino-2-butenoic acid methyl ester
OPENEYE Name: methyl (E)-3-aminobut-2-enoate
IUPAC Name: methyl (E)-3-aminobut-2-enoate
SYSTEMATIC NAME: methyl (E)-3-azanylbut-2-enoate
MOLECULAR FORMULA: C5H9NO2
MOLECULAR WEIGHT: 115.13046
SMILES: C/C(=C\C(=O)OC)/N
Structure:
CAS RN: 10347-93-0
CAS Name: (3S)-3-methylpentanoic acid
OPENEYE Name: (3S)-3-methylpentanoic acid
IUPAC Name: (3S)-3-methylpentanoic acid
SYSTEMATIC NAME: (3S)-3-methylpentanoic acid
MOLECULAR FORMULA: C6H12O2
MOLECULAR WEIGHT: 116.15828
SMILES: CC[C@H](C)CC(=O)O
Structure:
CAS RN: 119291-22-4
CAS Name: 1-(2-bromoethyl)pyrazole
OPENEYE Name: 1-(2-bromoethyl)pyrazole
IUPAC Name: 1-(2-bromoethyl)pyrazole
SYSTEMATIC NAME: 1-(2-bromoethyl)pyrazole
MOLECULAR FORMULA: C5H7BrN2
MOLECULAR WEIGHT: 175.02648
SMILES: C1=CN(N=C1)CCBr
Structure:
CAS RN: 96450-53-2
CAS Name: 1-(2-chloroethyl)pyrazole
OPENEYE Name: 1-(2-chloroethyl)pyrazole
IUPAC Name: 1-(2-chloroethyl)pyrazole
SYSTEMATIC NAME: 1-(2-chloroethyl)pyrazole
MOLECULAR FORMULA: C5H7ClN2
MOLECULAR WEIGHT: 130.57548
SMILES: C1=CN(N=C1)CCCl
Structure:
CAS RN: 764-41-0
CAS Name: (E)-1,4-dichloro-2-butene
OPENEYE Name: (E)-1,4-dichlorobut-2-ene
IUPAC Name: (E)-1,4-dichlorobut-2-ene
SYSTEMATIC NAME: (E)-1,4-bis(chloranyl)but-2-ene
MOLECULAR FORMULA: C4H6Cl2
MOLECULAR WEIGHT: 124.99644
SMILES: C(/C=C/CCl)Cl
Structure:
CAS RN: 110-57-6
CAS Name: (E)-1,4-dichloro-2-butene
OPENEYE Name: (E)-1,4-dichlorobut-2-ene
IUPAC Name: (E)-1,4-dichlorobut-2-ene
SYSTEMATIC NAME: (E)-1,4-bis(chloranyl)but-2-ene
MOLECULAR FORMULA: C4H6Cl2
MOLECULAR WEIGHT: 124.99644
SMILES: C(/C=C/CCl)Cl
Structure:
CAS RN: 3375-22-2
CAS Name: (E)-1,3-dichloro-2-methyl-1-propene
OPENEYE Name: (E)-1,3-dichloro-2-methyl-prop-1-ene
IUPAC Name: (E)-1,3-dichloro-2-methylprop-1-ene
SYSTEMATIC NAME: (E)-1,3-bis(chloranyl)-2-methyl-prop-1-ene
MOLECULAR FORMULA: C4H6Cl2
MOLECULAR WEIGHT: 124.99644
SMILES: C/C(=C\Cl)/CCl
Structure:
CAS RN: 38585-77-2
CAS Name: 3,3-dichloro-1-butene
OPENEYE Name: 3,3-dichlorobut-1-ene
IUPAC Name: 3,3-dichlorobut-1-ene
SYSTEMATIC NAME: 3,3-bis(chloranyl)but-1-ene
MOLECULAR FORMULA: C4H6Cl2
MOLECULAR WEIGHT: 124.99644
SMILES: CC(C=C)(Cl)Cl
Structure:
CAS RN: 39185-82-5
CAS Name: 1,1,3,3-tetrachlorobutane
OPENEYE Name: 1,1,3,3-tetrachlorobutane
IUPAC Name: 1,1,3,3-tetrachlorobutane
SYSTEMATIC NAME: 1,1,3,3-tetrakis(chloranyl)butane
MOLECULAR FORMULA: C4H6Cl4
MOLECULAR WEIGHT: 195.90244
SMILES: CC(CC(Cl)Cl)(Cl)Cl
Structure:
CAS RN: 42061-89-2
CAS Name: 5-formyl-2-furancarbonitrile
OPENEYE Name: 5-formylfuran-2-carbonitrile
IUPAC Name: 5-formylfuran-2-carbonitrile
SYSTEMATIC NAME: 5-methanoylfuran-2-carbonitrile
MOLECULAR FORMULA: C6H3NO2
MOLECULAR WEIGHT: 121.09352
SMILES: C1=C(OC(=C1)C#N)C=O
Structure:
CAS RN: 112372-06-2
CAS Name: 2-furo[2,3-c]pyridinecarboxaldehyde
OPENEYE Name: furo[2,3-c]pyridine-2-carbaldehyde
IUPAC Name: furo[2,3-c]pyridine-2-carbaldehyde
SYSTEMATIC NAME: furo[2,3-c]pyridine-2-carbaldehyde
MOLECULAR FORMULA: C8H5NO2
MOLECULAR WEIGHT: 147.1308
SMILES: C1=CN=CC2=C1C=C(O2)C=O
Structure:
CAS RN: 28588-73-0
CAS Name: 3-[(2,5-dimethyl-3-furanyl)disulfanyl]-2,5-dimethylfuran
OPENEYE Name: 3-[(2,5-dimethyl-3-furyl)disulfanyl]-2,5-dimethyl-furan
IUPAC Name: 3-[(2,5-dimethylfuran-3-yl)disulfanyl]-2,5-dimethylfuran
SYSTEMATIC NAME: 3-[(2,5-dimethylfuran-3-yl)disulfanyl]-2,5-dimethyl-furan
MOLECULAR FORMULA: C12H14O2S2
MOLECULAR WEIGHT: 254.36836
SMILES: CC1=CC(=C(O1)C)SSC2=C(OC(=C2)C)C
Structure:
CAS RN: 320-94-5
CAS Name: 2-nitro-4-(trifluoromethyl)benzoic acid
OPENEYE Name: 2-nitro-4-(trifluoromethyl)benzoic acid
IUPAC Name: 2-nitro-4-(trifluoromethyl)benzoic acid
SYSTEMATIC NAME: 2-nitro-4-(trifluoromethyl)benzoic acid
MOLECULAR FORMULA: C8H4F3NO4
MOLECULAR WEIGHT: 235.11687
SMILES: C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])C(=O)O
Structure:
CAS RN: 10321-71-8
CAS Name: (E)-4-methyl-2-pentenoic acid
OPENEYE Name: (E)-4-methylpent-2-enoic acid
IUPAC Name: (E)-4-methylpent-2-enoic acid
SYSTEMATIC NAME: (E)-4-methylpent-2-enoic acid
MOLECULAR FORMULA: C6H10O2
MOLECULAR WEIGHT: 114.1424
SMILES: CC(C)/C=C/C(=O)O
Structure:
CAS RN: 626-99-3
CAS Name: (2E)-penta-2,4-dienoic acid
OPENEYE Name: (2E)-penta-2,4-dienoic acid
IUPAC Name: (2E)-penta-2,4-dienoic acid
SYSTEMATIC NAME: (2E)-penta-2,4-dienoic acid
MOLECULAR FORMULA: C5H6O2
MOLECULAR WEIGHT: 98.09994
SMILES: C=C/C=C/C(=O)O
Structure:
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