Tuesday, December 13, 2011

http://ChemLookup.com Compounds




CAS RN: 23838-26-8
CAS Name: 1-[[(Z)-prop-1-enyl]trisulfanyl]propane
OPENEYE Name: 1-[[(Z)-prop-1-enyl]trisulfanyl]propane
IUPAC Name: 1-[[(Z)-prop-1-enyl]trisulfanyl]propane
SYSTEMATIC NAME: 1-[[(Z)-prop-1-enyl]trisulfanyl]propane
MOLECULAR FORMULA: C6H12S3
MOLECULAR WEIGHT: 180.35448
SMILES: CCCSSS/C=C\C
Structure:

CAS RN: 23838-27-9
CAS Name: 1-[[(E)-prop-1-enyl]trisulfanyl]propane
OPENEYE Name: 1-[[(E)-prop-1-enyl]trisulfanyl]propane
IUPAC Name: 1-[[(E)-prop-1-enyl]trisulfanyl]propane
SYSTEMATIC NAME: 1-[[(E)-prop-1-enyl]trisulfanyl]propane
MOLECULAR FORMULA: C6H12S3
MOLECULAR WEIGHT: 180.35448
SMILES: CCCSSS/C=C/C
Structure:

CAS RN: 56219-06-8
CAS Name: (Z)-9-tetradecenoic acid methyl ester
OPENEYE Name: methyl (Z)-tetradec-9-enoate
IUPAC Name: methyl (Z)-tetradec-9-enoate
SYSTEMATIC NAME: methyl (Z)-tetradec-9-enoate
MOLECULAR FORMULA: C15H28O2
MOLECULAR WEIGHT: 240.38162
SMILES: CCCC/C=C\CCCCCCCC(=O)OC
Structure:

CAS RN: 19780-68-8
CAS Name: (E)-3-ethyl-4-methyl-2-pentene
OPENEYE Name: (E)-3-ethyl-4-methyl-pent-2-ene
IUPAC Name: (E)-3-ethyl-4-methylpent-2-ene
SYSTEMATIC NAME: (E)-3-ethyl-4-methyl-pent-2-ene
MOLECULAR FORMULA: C8H16
MOLECULAR WEIGHT: 112.21264
SMILES: CC/C(=C\C)/C(C)C
Structure:

CAS RN: 19780-46-2
CAS Name: (E)-4-ethyl-2-hexene
OPENEYE Name: (E)-4-ethylhex-2-ene
IUPAC Name: (E)-4-ethylhex-2-ene
SYSTEMATIC NAME: (E)-4-ethylhex-2-ene
MOLECULAR FORMULA: C8H16
MOLECULAR WEIGHT: 112.21264
SMILES: CCC(CC)/C=C/C
Structure:

CAS RN: 19550-83-5
CAS Name: (E)-4,4-dimethyl-2-hexene
OPENEYE Name: (E)-4,4-dimethylhex-2-ene
IUPAC Name: (E)-4,4-dimethylhex-2-ene
SYSTEMATIC NAME: (E)-4,4-dimethylhex-2-ene
MOLECULAR FORMULA: C8H16
MOLECULAR WEIGHT: 112.21264
SMILES: CCC(C)(C)/C=C/C
Structure:

CAS RN: 19550-82-4
CAS Name: (E)-3,4-dimethyl-2-hexene
OPENEYE Name: (E)-3,4-dimethylhex-2-ene
IUPAC Name: (E)-3,4-dimethylhex-2-ene
SYSTEMATIC NAME: (E)-3,4-dimethylhex-2-ene
MOLECULAR FORMULA: C8H16
MOLECULAR WEIGHT: 112.21264
SMILES: CCC(C)/C(=C/C)/C
Structure:

CAS RN: 2213-37-8
CAS Name: (E)-3,4-dimethyl-2-hexene
OPENEYE Name: (E)-3,4-dimethylhex-2-ene
IUPAC Name: (E)-3,4-dimethylhex-2-ene
SYSTEMATIC NAME: (E)-3,4-dimethylhex-2-ene
MOLECULAR FORMULA: C8H16
MOLECULAR WEIGHT: 112.21264
SMILES: CCC(C)/C(=C/C)/C
Structure:

CAS RN: 20710-38-7
CAS Name: (E)-3-methyl-2-hexene
OPENEYE Name: (E)-3-methylhex-2-ene
IUPAC Name: (E)-3-methylhex-2-ene
SYSTEMATIC NAME: (E)-3-methylhex-2-ene
MOLECULAR FORMULA: C7H14
MOLECULAR WEIGHT: 98.18606
SMILES: CCC/C(=C/C)/C
Structure:

CAS RN: 17618-77-8
CAS Name: (E)-3-methyl-2-hexene
OPENEYE Name: (E)-3-methylhex-2-ene
IUPAC Name: (E)-3-methylhex-2-ene
SYSTEMATIC NAME: (E)-3-methylhex-2-ene
MOLECULAR FORMULA: C7H14
MOLECULAR WEIGHT: 98.18606
SMILES: CCC/C(=C/C)/C
Structure:

CAS RN: 19550-75-5
CAS Name: (E)-2,2-dimethyl-3-heptene
OPENEYE Name: (E)-2,2-dimethylhept-3-ene
IUPAC Name: (E)-2,2-dimethylhept-3-ene
SYSTEMATIC NAME: (E)-2,2-dimethylhept-3-ene
MOLECULAR FORMULA: C9H18
MOLECULAR WEIGHT: 126.23922
SMILES: CCC/C=C/C(C)(C)C
Structure:

CAS RN: 3404-56-6
CAS Name: (E)-4-methyl-2-heptene
OPENEYE Name: (E)-4-methylhept-2-ene
IUPAC Name: (E)-4-methylhept-2-ene
SYSTEMATIC NAME: (E)-4-methylhept-2-ene
MOLECULAR FORMULA: C8H16
MOLECULAR WEIGHT: 112.21264
SMILES: CCCC(C)/C=C/C
Structure:

CAS RN: 66225-17-0
CAS Name: (E)-4-methyl-2-heptene
OPENEYE Name: (E)-4-methylhept-2-ene
IUPAC Name: (E)-4-methylhept-2-ene
SYSTEMATIC NAME: (E)-4-methylhept-2-ene
MOLECULAR FORMULA: C8H16
MOLECULAR WEIGHT: 112.21264
SMILES: CCCC(C)/C=C/C
Structure:

CAS RN: 49627-27-2
CAS Name: 2-[(3Z)-6-fluoro-2-methyl-3-[[4-(methylthio)phenyl]methylidene]-1-indenyl]acetic acid
OPENEYE Name: 2-[(3Z)-6-fluoro-2-methyl-3-[(4-methylsulfanylphenyl)methylene]inden-1-yl]acetic acid
IUPAC Name: 2-[(3Z)-6-fluoro-2-methyl-3-[(4-methylsulfanylphenyl)methylidene]inden-1-yl]acetic acid
SYSTEMATIC NAME: 2-[(3Z)-6-fluoranyl-2-methyl-3-[(4-methylsulfanylphenyl)methylidene]inden-1-yl]ethanoic acid
MOLECULAR FORMULA: C20H17FO2S
MOLECULAR WEIGHT: 340.411183
SMILES: CC\1=C(C2=C(/C1=C\C3=CC=C(C=C3)SC)C=CC(=C2)F)CC(=O)O
Structure:

CAS RN: 72200-74-9
CAS Name: benzoic acid [(E)-hex-3-enyl] ester
OPENEYE Name: [(E)-hex-3-enyl] benzoate
IUPAC Name: [(E)-hex-3-enyl] benzoate
SYSTEMATIC NAME: [(E)-hex-3-enyl] benzoate
MOLECULAR FORMULA: C13H16O2
MOLECULAR WEIGHT: 204.26494
SMILES: CC/C=C/CCOC(=O)C1=CC=CC=C1
Structure:

CAS RN: 13152-05-1
CAS Name: (1Z)-3-methylcyclooctene
OPENEYE Name: (1Z)-3-methylcyclooctene
IUPAC Name: (1Z)-3-methylcyclooctene
SYSTEMATIC NAME: (1Z)-3-methylcyclooctene
MOLECULAR FORMULA: C9H16
MOLECULAR WEIGHT: 124.22334
SMILES: CC/1CCCCC/C=C1
Structure:

CAS RN: 1708-82-3
CAS Name: acetic acid [(E)-hex-3-enyl] ester
OPENEYE Name: [(E)-hex-3-enyl] acetate
IUPAC Name: [(E)-hex-3-enyl] acetate
SYSTEMATIC NAME: [(E)-hex-3-enyl] ethanoate
MOLECULAR FORMULA: C8H14O2
MOLECULAR WEIGHT: 142.19556
SMILES: CC/C=C/CCOC(=O)C
Structure:

CAS RN: 3681-82-1
CAS Name: acetic acid [(E)-hex-3-enyl] ester
OPENEYE Name: [(E)-hex-3-enyl] acetate
IUPAC Name: [(E)-hex-3-enyl] acetate
SYSTEMATIC NAME: [(E)-hex-3-enyl] ethanoate
MOLECULAR FORMULA: C8H14O2
MOLECULAR WEIGHT: 142.19556
SMILES: CC/C=C/CCOC(=O)C
Structure:

CAS RN: 692-24-0
CAS Name: (E)-2-methyl-3-hexene
OPENEYE Name: (E)-2-methylhex-3-ene
IUPAC Name: (E)-2-methylhex-3-ene
SYSTEMATIC NAME: (E)-2-methylhex-3-ene
MOLECULAR FORMULA: C7H14
MOLECULAR WEIGHT: 98.18606
SMILES: CC/C=C/C(C)C
Structure:

CAS RN: 42154-69-8
CAS Name: (E)-2-methyl-3-hexene
OPENEYE Name: (E)-2-methylhex-3-ene
IUPAC Name: (E)-2-methylhex-3-ene
SYSTEMATIC NAME: (E)-2-methylhex-3-ene
MOLECULAR FORMULA: C7H14
MOLECULAR WEIGHT: 98.18606
SMILES: CC/C=C/C(C)C
Structure:

CAS RN: 933-11-9
CAS Name: (1Z)-1-methylcyclooctene
OPENEYE Name: (1Z)-1-methylcyclooctene
IUPAC Name: (1Z)-1-methylcyclooctene
SYSTEMATIC NAME: (1Z)-1-methylcyclooctene
MOLECULAR FORMULA: C9H16
MOLECULAR WEIGHT: 124.22334
SMILES: C/C/1=C/CCCCCC1
Structure:

CAS RN: 31501-11-8
CAS Name: hexanoic acid [(Z)-hex-3-enyl] ester
OPENEYE Name: [(Z)-hex-3-enyl] hexanoate
IUPAC Name: [(Z)-hex-3-enyl] hexanoate
SYSTEMATIC NAME: [(Z)-hex-3-enyl] hexanoate
MOLECULAR FORMULA: C12H22O2
MOLECULAR WEIGHT: 198.30188
SMILES: CCCCCC(=O)OCC/C=C\CC
Structure:

CAS RN: 82780-67-4
CAS Name: hexanoic acid [(Z)-hex-3-enyl] ester
OPENEYE Name: [(Z)-hex-3-enyl] hexanoate
IUPAC Name: [(Z)-hex-3-enyl] hexanoate
SYSTEMATIC NAME: [(Z)-hex-3-enyl] hexanoate
MOLECULAR FORMULA: C12H22O2
MOLECULAR WEIGHT: 198.30188
SMILES: CCCCCC(=O)OCC/C=C\CC
Structure:

CAS RN: 41519-23-7
CAS Name: 2-methylpropanoic acid [(Z)-hex-3-enyl] ester
OPENEYE Name: [(Z)-hex-3-enyl] 2-methylpropanoate
IUPAC Name: [(Z)-hex-3-enyl] 2-methylpropanoate
SYSTEMATIC NAME: [(Z)-hex-3-enyl] 2-methylpropanoate
MOLECULAR FORMULA: C10H18O2
MOLECULAR WEIGHT: 170.24872
SMILES: CC/C=C\CCOC(=O)C(C)C
Structure:

CAS RN: 57859-47-9
CAS Name: 2-methylpropanoic acid [(Z)-hex-3-enyl] ester
OPENEYE Name: [(Z)-hex-3-enyl] 2-methylpropanoate
IUPAC Name: [(Z)-hex-3-enyl] 2-methylpropanoate
SYSTEMATIC NAME: [(Z)-hex-3-enyl] 2-methylpropanoate
MOLECULAR FORMULA: C10H18O2
MOLECULAR WEIGHT: 170.24872
SMILES: CC/C=C\CCOC(=O)C(C)C
Structure:

CAS RN: 94434-40-9
CAS Name: (Z)-2-nonadecene
OPENEYE Name: (Z)-nonadec-2-ene
IUPAC Name: (Z)-nonadec-2-ene
SYSTEMATIC NAME: (Z)-nonadec-2-ene
MOLECULAR FORMULA: C19H38
MOLECULAR WEIGHT: 266.50502
SMILES: CCCCCCCCCCCCCCCC/C=C\C
Structure:

CAS RN: 10339-60-3
CAS Name: (E)-3-decen-1-ol
OPENEYE Name: (E)-dec-3-en-1-ol
IUPAC Name: (E)-dec-3-en-1-ol
SYSTEMATIC NAME: (E)-dec-3-en-1-ol
MOLECULAR FORMULA: C10H20O
MOLECULAR WEIGHT: 156.2652
SMILES: CCCCCC/C=C/CCO
Structure:

CAS RN: 69093-74-9
CAS Name: (E)-3-decen-1-ol
OPENEYE Name: (E)-dec-3-en-1-ol
IUPAC Name: (E)-dec-3-en-1-ol
SYSTEMATIC NAME: (E)-dec-3-en-1-ol
MOLECULAR FORMULA: C10H20O
MOLECULAR WEIGHT: 156.2652
SMILES: CCCCCC/C=C/CCO
Structure:

CAS RN: 71607-52-8
CAS Name: heptanoic acid [(E)-3-phenylprop-2-enyl] ester
OPENEYE Name: [(E)-cinnamyl] heptanoate
IUPAC Name: [(E)-3-phenylprop-2-enyl] heptanoate
SYSTEMATIC NAME: [(E)-3-phenylprop-2-enyl] heptanoate
MOLECULAR FORMULA: C16H22O2
MOLECULAR WEIGHT: 246.34468
SMILES: CCCCCCC(=O)OC/C=C/C1=CC=CC=C1
Structure:

CAS RN: 34678-40-5
CAS Name: 1-[(E)-hex-1-enyl]-1-cyclohexanol
OPENEYE Name: 1-[(E)-hex-1-enyl]cyclohexanol
IUPAC Name: 1-[(E)-hex-1-enyl]cyclohexan-1-ol
SYSTEMATIC NAME: 1-[(E)-hex-1-enyl]cyclohexan-1-ol
MOLECULAR FORMULA: C12H22O
MOLECULAR WEIGHT: 182.30248
SMILES: CCCC/C=C/C1(CCCCC1)O
Structure:

CAS RN: 36340-49-5
CAS Name: (E)-4-(1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-6-yl)-3-buten-2-one
OPENEYE Name: (E)-4-(1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-6-yl)but-3-en-2-one
IUPAC Name: (E)-4-(1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-6-yl)but-3-en-2-one
SYSTEMATIC NAME: (E)-4-(1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-6-yl)but-3-en-2-one
MOLECULAR FORMULA: C13H20O2
MOLECULAR WEIGHT: 208.2967
SMILES: CC(=O)/C=C/C12C(CCCC1(O2)C)(C)C
Structure:

CAS RN: 2492-22-0
CAS Name: (6Z)-2,6-dimethylocta-2,6-diene
OPENEYE Name: (6Z)-2,6-dimethylocta-2,6-diene
IUPAC Name: (6Z)-2,6-dimethylocta-2,6-diene
SYSTEMATIC NAME: (6Z)-2,6-dimethylocta-2,6-diene
MOLECULAR FORMULA: C10H18
MOLECULAR WEIGHT: 138.24992
SMILES: C/C=C(/C)\CCC=C(C)C
Structure:

CAS RN: 53398-80-4
CAS Name: propanoic acid [(E)-hex-2-enyl] ester
OPENEYE Name: [(E)-hex-2-enyl] propanoate
IUPAC Name: [(E)-hex-2-enyl] propanoate
SYSTEMATIC NAME: [(E)-hex-2-enyl] propanoate
MOLECULAR FORMULA: C9H16O2
MOLECULAR WEIGHT: 156.22214
SMILES: CCC/C=C/COC(=O)CC
Structure:

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