CAS RN: 139729-91-2
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:
CAS RN: 53398-83-7
CAS Name: butanoic acid [(E)-hex-2-enyl] ester
OPENEYE Name: [(E)-hex-2-enyl] butanoate
IUPAC Name: [(E)-hex-2-enyl] butanoate
SYSTEMATIC NAME: [(E)-hex-2-enyl] butanoate
MOLECULAR FORMULA: C10H18O2
MOLECULAR WEIGHT: 170.24872
SMILES: CCC/C=C/COC(=O)CCC
Structure:
CAS RN: 68698-59-9
CAS Name: 3-methylbutanoic acid [(E)-hex-2-enyl] ester
OPENEYE Name: [(E)-hex-2-enyl] 3-methylbutanoate
IUPAC Name: [(E)-hex-2-enyl] 3-methylbutanoate
SYSTEMATIC NAME: [(E)-hex-2-enyl] 3-methylbutanoate
MOLECULAR FORMULA: C11H20O2
MOLECULAR WEIGHT: 184.2753
SMILES: CCC/C=C/COC(=O)CC(C)C
Structure:
CAS RN: 94089-01-7
CAS Name: 2-methylbutanoic acid [(E)-hex-2-enyl] ester
OPENEYE Name: [(E)-hex-2-enyl] 2-methylbutanoate
IUPAC Name: [(E)-hex-2-enyl] 2-methylbutanoate
SYSTEMATIC NAME: [(E)-hex-2-enyl] 2-methylbutanoate
MOLECULAR FORMULA: C11H20O2
MOLECULAR WEIGHT: 184.2753
SMILES: CCC/C=C/COC(=O)C(C)CC
Structure:
CAS RN: 13741-21-4
CAS Name: (3E)-2,6-dimethylocta-3,7-diene-2,6-diol
OPENEYE Name: (3E)-2,6-dimethylocta-3,7-diene-2,6-diol
IUPAC Name: (3E)-2,6-dimethylocta-3,7-diene-2,6-diol
SYSTEMATIC NAME: (3E)-2,6-dimethylocta-3,7-diene-2,6-diol
MOLECULAR FORMULA: C10H18O2
MOLECULAR WEIGHT: 170.24872
SMILES: CC(C)(/C=C/CC(C)(C=C)O)O
Structure:
CAS RN: 7785-66-2
CAS Name: (E)-2-methyl-2-butenoic acid butyl ester
OPENEYE Name: butyl (E)-2-methylbut-2-enoate
IUPAC Name: butyl (E)-2-methylbut-2-enoate
SYSTEMATIC NAME: butyl (E)-2-methylbut-2-enoate
MOLECULAR FORMULA: C9H16O2
MOLECULAR WEIGHT: 156.22214
SMILES: CCCCOC(=O)/C(=C/C)/C
Structure:
CAS RN: 3899-36-3
CAS Name: (E)-3-methyl-3-hexene
OPENEYE Name: (E)-3-methylhex-3-ene
IUPAC Name: (E)-3-methylhex-3-ene
SYSTEMATIC NAME: (E)-3-methylhex-3-ene
MOLECULAR FORMULA: C7H14
MOLECULAR WEIGHT: 98.18606
SMILES: CC/C=C(\C)/CC
Structure:
CAS RN: 16491-36-4
CAS Name: butanoic acid [(Z)-hex-3-enyl] ester
OPENEYE Name: [(Z)-hex-3-enyl] butanoate
IUPAC Name: [(Z)-hex-3-enyl] butanoate
SYSTEMATIC NAME: [(Z)-hex-3-enyl] butanoate
MOLECULAR FORMULA: C10H18O2
MOLECULAR WEIGHT: 170.24872
SMILES: CCCC(=O)OCC/C=C\CC
Structure:
CAS RN: 7549-37-3
CAS Name: (2E)-1,1-dimethoxy-3,7-dimethylocta-2,6-diene
OPENEYE Name: (2E)-1,1-dimethoxy-3,7-dimethyl-octa-2,6-diene
IUPAC Name: (2E)-1,1-dimethoxy-3,7-dimethylocta-2,6-diene
SYSTEMATIC NAME: (2E)-1,1-dimethoxy-3,7-dimethyl-octa-2,6-diene
MOLECULAR FORMULA: C12H22O2
MOLECULAR WEIGHT: 198.30188
SMILES: CC(=CCC/C(=C/C(OC)OC)/C)C
Structure:
CAS RN: 70795-75-4
CAS Name: acetic acid [(E)-3,7-dimethyloct-2-enyl] ester
OPENEYE Name: [(E)-3,7-dimethyloct-2-enyl] acetate
IUPAC Name: [(E)-3,7-dimethyloct-2-enyl] acetate
SYSTEMATIC NAME: [(E)-3,7-dimethyloct-2-enyl] ethanoate
MOLECULAR FORMULA: C12H22O2
MOLECULAR WEIGHT: 198.30188
SMILES: CC(C)CCC/C(=C/COC(=O)C)/C
Structure:
CAS RN: 85851-87-2
CAS Name: acetic acid [(E)-3,7-dimethyloct-2-enyl] ester
OPENEYE Name: [(E)-3,7-dimethyloct-2-enyl] acetate
IUPAC Name: [(E)-3,7-dimethyloct-2-enyl] acetate
SYSTEMATIC NAME: [(E)-3,7-dimethyloct-2-enyl] ethanoate
MOLECULAR FORMULA: C12H22O2
MOLECULAR WEIGHT: 198.30188
SMILES: CC(C)CCC/C(=C/COC(=O)C)/C
Structure:
CAS RN: 73528-38-8
CAS Name: (E)-3-(3-pentyl-2-oxiranyl)-2-propenal
OPENEYE Name: (E)-3-(3-pentyloxiran-2-yl)prop-2-enal
IUPAC Name: (E)-3-(3-pentyloxiran-2-yl)prop-2-enal
SYSTEMATIC NAME: (E)-3-(3-pentyloxiran-2-yl)prop-2-enal
MOLECULAR FORMULA: C10H16O2
MOLECULAR WEIGHT: 168.23284
SMILES: CCCCCC1C(O1)/C=C/C=O
Structure:
CAS RN: 18679-18-0
CAS Name: 5-[(Z)-oct-2-enyl]-2-oxolanone
OPENEYE Name: 5-[(Z)-oct-2-enyl]tetrahydrofuran-2-one
IUPAC Name: 5-[(Z)-oct-2-enyl]oxolan-2-one
SYSTEMATIC NAME: 5-[(Z)-oct-2-enyl]oxolan-2-one
MOLECULAR FORMULA: C12H20O2
MOLECULAR WEIGHT: 196.286
SMILES: CCCCC/C=C\CC1CCC(=O)O1
Structure:
CAS RN: 7440-31-5
CAS Name: tin
OPENEYE Name: tin
IUPAC Name: tin
SYSTEMATIC NAME: tin
MOLECULAR FORMULA: Sn
MOLECULAR WEIGHT: 118.71
SMILES: [Sn]
Structure:
CAS RN: 7439-92-1
CAS Name: lead
OPENEYE Name: lead
IUPAC Name: lead
SYSTEMATIC NAME: lead
MOLECULAR FORMULA: Pb
MOLECULAR WEIGHT: 207.2
SMILES: [Pb]
Structure:
CAS RN: 14701-27-0
CAS Name: lead
OPENEYE Name: lead
IUPAC Name: lead
SYSTEMATIC NAME: lead
MOLECULAR FORMULA: Pb
MOLECULAR WEIGHT: 207.2
SMILES: [Pb]
Structure:
CAS RN: 15158-12-0
CAS Name: lead
OPENEYE Name: lead
IUPAC Name: lead
SYSTEMATIC NAME: lead
MOLECULAR FORMULA: Pb
MOLECULAR WEIGHT: 207.2
SMILES: [Pb]
Structure:
CAS RN: 54076-28-7
CAS Name: lead
OPENEYE Name: lead
IUPAC Name: lead
SYSTEMATIC NAME: lead
MOLECULAR FORMULA: Pb
MOLECULAR WEIGHT: 207.2
SMILES: [Pb]
Structure:
CAS RN: 724427-66-1
CAS Name: lead
OPENEYE Name: lead
IUPAC Name: lead
SYSTEMATIC NAME: lead
MOLECULAR FORMULA: Pb
MOLECULAR WEIGHT: 207.2
SMILES: [Pb]
Structure:
CAS RN: 136173-26-7
CAS Name: (E)-2-(hydroxymethyl)-2-butenoic acid [7-[(Z)-2-methyl-1-oxobut-2-enoxy]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl ester
OPENEYE Name: [7-[(Z)-2-methylbut-2-enoyl]oxy-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (E)-2-(hydroxymethyl)but-2-enoate
IUPAC Name: [7-[(Z)-2-methylbut-2-enoyl]oxy-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (E)-2-(hydroxymethyl)but-2-enoate
SYSTEMATIC NAME: [7-[(Z)-2-methylbut-2-enoyl]oxy-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (E)-2-(hydroxymethyl)but-2-enoate
MOLECULAR FORMULA: C18H27NO5
MOLECULAR WEIGHT: 337.41068
SMILES: C/C=C(/C)\C(=O)OC1CCN2C1C(CC2)COC(=O)/C(=C/C)/CO
Structure:
CAS RN: 103091-69-6
CAS Name: acetic acid [(E)-dodec-10-enyl] ester
OPENEYE Name: [(E)-dodec-10-enyl] acetate
IUPAC Name: [(E)-dodec-10-enyl] acetate
SYSTEMATIC NAME: [(E)-dodec-10-enyl] ethanoate
MOLECULAR FORMULA: C14H26O2
MOLECULAR WEIGHT: 226.35504
SMILES: C/C=C/CCCCCCCCCOC(=O)C
Structure:
CAS RN: 35153-09-4
CAS Name: acetic acid [(E)-dodec-10-enyl] ester
OPENEYE Name: [(E)-dodec-10-enyl] acetate
IUPAC Name: [(E)-dodec-10-enyl] acetate
SYSTEMATIC NAME: [(E)-dodec-10-enyl] ethanoate
MOLECULAR FORMULA: C14H26O2
MOLECULAR WEIGHT: 226.35504
SMILES: C/C=C/CCCCCCCCCOC(=O)C
Structure:
CAS RN: 5457-80-7
CAS Name: 1-chloro-4-[(E)-2-(4-chlorophenyl)ethenyl]benzene
OPENEYE Name: 1-chloro-4-[(E)-2-(4-chlorophenyl)vinyl]benzene
IUPAC Name: 1-chloro-4-[(E)-2-(4-chlorophenyl)ethenyl]benzene
SYSTEMATIC NAME: 1-chloranyl-4-[(E)-2-(4-chlorophenyl)ethenyl]benzene
MOLECULAR FORMULA: C14H10Cl2
MOLECULAR WEIGHT: 249.1352
SMILES: C1=CC(=CC=C1/C=C/C2=CC=C(C=C2)Cl)Cl
Structure:
CAS RN: 7367-83-1
CAS Name: (Z)-4-decenoic acid methyl ester
OPENEYE Name: methyl (Z)-dec-4-enoate
IUPAC Name: methyl (Z)-dec-4-enoate
SYSTEMATIC NAME: methyl (Z)-dec-4-enoate
MOLECULAR FORMULA: C11H20O2
MOLECULAR WEIGHT: 184.2753
SMILES: CCCCC/C=C\CCC(=O)OC
Structure:
CAS RN: 19883-27-3
CAS Name: (3E,5Z)-undeca-1,3,5-triene
OPENEYE Name: (3E,5Z)-undeca-1,3,5-triene
IUPAC Name: (3E,5Z)-undeca-1,3,5-triene
SYSTEMATIC NAME: (3E,5Z)-undeca-1,3,5-triene
MOLECULAR FORMULA: C11H18
MOLECULAR WEIGHT: 150.26062
SMILES: CCCCC/C=C\C=C\C=C
Structure:
CAS RN: 51447-08-6
CAS Name: (3E,5Z)-undeca-1,3,5-triene
OPENEYE Name: (3E,5Z)-undeca-1,3,5-triene
IUPAC Name: (3E,5Z)-undeca-1,3,5-triene
SYSTEMATIC NAME: (3E,5Z)-undeca-1,3,5-triene
MOLECULAR FORMULA: C11H18
MOLECULAR WEIGHT: 150.26062
SMILES: CCCCC/C=C\C=C\C=C
Structure:
CAS RN: 50277-31-1
CAS Name: (3E,5E,8Z)-undeca-1,3,5,8-tetraene
OPENEYE Name: (3E,5E,8Z)-undeca-1,3,5,8-tetraene
IUPAC Name: (3E,5E,8Z)-undeca-1,3,5,8-tetraene
SYSTEMATIC NAME: (3E,5E,8Z)-undeca-1,3,5,8-tetraene
MOLECULAR FORMULA: C11H16
MOLECULAR WEIGHT: 148.24474
SMILES: CC/C=C\C/C=C/C=C/C=C
Structure:
CAS RN: 53398-84-8
CAS Name: butanoic acid [(E)-hex-3-enyl] ester
OPENEYE Name: [(E)-hex-3-enyl] butanoate
IUPAC Name: [(E)-hex-3-enyl] butanoate
SYSTEMATIC NAME: [(E)-hex-3-enyl] butanoate
MOLECULAR FORMULA: C10H18O2
MOLECULAR WEIGHT: 170.24872
SMILES: CCCC(=O)OCC/C=C/CC
Structure:
CAS RN: 52957-16-1
CAS Name: (E)-9-tetradecen-1-ol
OPENEYE Name: (E)-tetradec-9-en-1-ol
IUPAC Name: (E)-tetradec-9-en-1-ol
SYSTEMATIC NAME: (E)-tetradec-9-en-1-ol
MOLECULAR FORMULA: C14H28O
MOLECULAR WEIGHT: 212.37152
SMILES: CCCC/C=C/CCCCCCCCO
Structure:
CAS RN: 61301-56-2
CAS Name: (E)-11-hexadecen-1-ol
OPENEYE Name: (E)-hexadec-11-en-1-ol
IUPAC Name: (E)-hexadec-11-en-1-ol
SYSTEMATIC NAME: (E)-hexadec-11-en-1-ol
MOLECULAR FORMULA: C16H32O
MOLECULAR WEIGHT: 240.42468
SMILES: CCCC/C=C/CCCCCCCCCCO
Structure:
CAS RN: 5135-18-2
CAS Name: (E)-3-chloro-2-propenoic acid methyl ester
OPENEYE Name: methyl (E)-3-chloroprop-2-enoate
IUPAC Name: methyl (E)-3-chloroprop-2-enoate
SYSTEMATIC NAME: methyl (E)-3-chloranylprop-2-enoate
MOLECULAR FORMULA: C4H5ClO2
MOLECULAR WEIGHT: 120.5343
SMILES: COC(=O)/C=C/Cl
Structure:
CAS RN: 61444-41-5
CAS Name: octanoic acid [(Z)-hex-3-enyl] ester
OPENEYE Name: [(Z)-hex-3-enyl] octanoate
IUPAC Name: [(Z)-hex-3-enyl] octanoate
SYSTEMATIC NAME: [(Z)-hex-3-enyl] octanoate
MOLECULAR FORMULA: C14H26O2
MOLECULAR WEIGHT: 226.35504
SMILES: CCCCCCCC(=O)OCC/C=C\CC
Structure:
CAS RN: 18899-19-9
CAS Name: (E)-7-hexadecene
OPENEYE Name: (E)-hexadec-7-ene
IUPAC Name: (E)-hexadec-7-ene
SYSTEMATIC NAME: (E)-hexadec-7-ene
MOLECULAR FORMULA: C16H32
MOLECULAR WEIGHT: 224.42528
SMILES: CCCCCCCC/C=C/CCCCCC
Structure:
CAS RN: 68155-00-0
CAS Name: (E)-3-heptadecene
OPENEYE Name: (E)-heptadec-3-ene
IUPAC Name: (E)-heptadec-3-ene
SYSTEMATIC NAME: (E)-heptadec-3-ene
MOLECULAR FORMULA: C17H34
MOLECULAR WEIGHT: 238.45186
SMILES: CCCCCCCCCCCCC/C=C/CC
Structure:
CAS RN: 4974-27-0
CAS Name: (2Z,6Z)-octa-2,6-diene
OPENEYE Name: (2Z,6Z)-octa-2,6-diene
IUPAC Name: (2Z,6Z)-octa-2,6-diene
SYSTEMATIC NAME: (2Z,6Z)-octa-2,6-diene
MOLECULAR FORMULA: C8H14
MOLECULAR WEIGHT: 110.19676
SMILES: C/C=C\CC/C=C\C
Structure:
CAS RN: 2074-04-6
CAS Name: 2,4-dinitro-N-[(E)-2-phenylethylideneamino]aniline
OPENEYE Name: 2,4-dinitro-N-[(E)-2-phenylethylideneamino]aniline
IUPAC Name: 2,4-dinitro-N-[(E)-2-phenylethylideneamino]aniline
SYSTEMATIC NAME: 2,4-dinitro-N-[(E)-2-phenylethylideneamino]aniline
MOLECULAR FORMULA: C14H12N4O4
MOLECULAR WEIGHT: 300.26948
SMILES: C1=CC=C(C=C1)C/C=N/NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 1726-78-9
CAS Name: N-[(E)-dodecylideneamino]-2,4-dinitroaniline
OPENEYE Name: N-[(E)-dodecylideneamino]-2,4-dinitro-aniline
IUPAC Name: N-[(E)-dodecylideneamino]-2,4-dinitroaniline
SYSTEMATIC NAME: N-[(E)-dodecylideneamino]-2,4-dinitro-aniline
MOLECULAR FORMULA: C18H28N4O4
MOLECULAR WEIGHT: 364.43932
SMILES: CCCCCCCCCCC/C=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 31551-27-6
CAS Name: (Z)-2-methyl-2-pentenenitrile
OPENEYE Name: (Z)-2-methylpent-2-enenitrile
IUPAC Name: (Z)-2-methylpent-2-enenitrile
SYSTEMATIC NAME: (Z)-2-methylpent-2-enenitrile
MOLECULAR FORMULA: C6H9N
MOLECULAR WEIGHT: 95.14236
SMILES: CC/C=C(/C)\C#N
Structure:
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