CAS RN: 35686-13-6
CAS Name: (E)-1-(ethylthio)-1-butene
OPENEYE Name: (E)-1-ethylsulfanylbut-1-ene
IUPAC Name: (E)-1-ethylsulfanylbut-1-ene
SYSTEMATIC NAME: (E)-1-ethylsulfanylbut-1-ene
MOLECULAR FORMULA: C6H12S
MOLECULAR WEIGHT: 116.22448
SMILES: CC/C=C/SCC
Structure:
CAS RN: 35533-29-0
CAS Name: 3-[[(Z)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]-2-sulfanylidene-4-thiazolidinone
OPENEYE Name: 3-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]-2-thioxo-thiazolidin-4-one
IUPAC Name: 3-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]-2-sulfanylidene-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 3-[[(Z)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]-2-sulfanylidene-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C10H8N2O2S2
MOLECULAR WEIGHT: 252.31272
SMILES: C1C(=O)N(C(=S)S1)N/C=C\2/C=CC=CC2=O
Structure:
CAS RN: 35468-97-4
CAS Name: acetic acid [(E)-hept-1-enyl] ester
OPENEYE Name: [(E)-hept-1-enyl] acetate
IUPAC Name: [(E)-hept-1-enyl] acetate
SYSTEMATIC NAME: [(E)-hept-1-enyl] ethanoate
MOLECULAR FORMULA: C9H16O2
MOLECULAR WEIGHT: 156.22214
SMILES: CCCCC/C=C/OC(=O)C
Structure:
CAS RN: 35383-51-8
CAS Name: (1E)-1-chloro-2-methylbuta-1,3-diene
OPENEYE Name: (1E)-1-chloro-2-methyl-buta-1,3-diene
IUPAC Name: (1E)-1-chloro-2-methylbuta-1,3-diene
SYSTEMATIC NAME: (1E)-1-chloranyl-2-methyl-buta-1,3-diene
MOLECULAR FORMULA: C5H7Cl
MOLECULAR WEIGHT: 102.56208
SMILES: C/C(=C\Cl)/C=C
Structure:
CAS RN: 35186-09-5
CAS Name: diethyl-[(Z)-1,1,1,4,4,4-hexafluorobut-2-en-2-yl]arsine
OPENEYE Name: diethyl-[(Z)-3,3,3-trifluoro-1-(trifluoromethyl)prop-1-enyl]arsane
IUPAC Name: diethyl-[(Z)-1,1,1,4,4,4-hexafluorobut-2-en-2-yl]arsane
SYSTEMATIC NAME: diethyl-[(Z)-1,1,1,4,4,4-hexakis(fluoranyl)but-2-en-2-yl]arsane
MOLECULAR FORMULA: C8H11AsF6
MOLECULAR WEIGHT: 296.084959
SMILES: CC[As](CC)/C(=C\C(F)(F)F)/C(F)(F)F
Structure:
CAS RN: 35186-00-6
CAS Name: (Z)-1,1,1,4,4,4-hexafluoro-N,N-dimethyl-2-buten-2-amine
OPENEYE Name: (Z)-1,1,1,4,4,4-hexafluoro-N,N-dimethyl-but-2-en-2-amine
IUPAC Name: (Z)-1,1,1,4,4,4-hexafluoro-N,N-dimethylbut-2-en-2-amine
SYSTEMATIC NAME: (Z)-1,1,1,4,4,4-hexakis(fluoranyl)-N,N-dimethyl-but-2-en-2-amine
MOLECULAR FORMULA: C6H7F6N
MOLECULAR WEIGHT: 207.116899
SMILES: CN(C)/C(=C\C(F)(F)F)/C(F)(F)F
Structure:
CAS RN: 3469-17-8
CAS Name: (E)-2-diazonio-1,2-diphenylethenolate
OPENEYE Name: (E)-2-diazonio-1,2-diphenyl-ethenolate
IUPAC Name: (E)-2-diazonio-1,2-diphenylethenolate
SYSTEMATIC NAME: (E)-2-diazonio-1,2-diphenyl-ethenolate
MOLECULAR FORMULA: C14H10N2O
MOLECULAR WEIGHT: 222.242
SMILES: C1=CC=C(C=C1)/C(=C(/C2=CC=CC=C2)\[O-])/[N+]#N
Structure:
CAS RN: 34458-54-3
CAS Name: cyclopentadecene
OPENEYE Name: cyclopentadecene
IUPAC Name: cyclopentadecene
SYSTEMATIC NAME: cyclopentadecene
MOLECULAR FORMULA: C15H28
MOLECULAR WEIGHT: 208.38282
SMILES: C1CCCCCC/C=C\CCCCCC1
Structure:
CAS RN: 3413-73-8
CAS Name: (5Z)-5-(ethylaminohydrazinylidene)-4-imidazolecarboxamide
OPENEYE Name: (5Z)-5-(ethylaminohydrazono)imidazole-4-carboxamide
IUPAC Name: (5Z)-5-(ethylaminohydrazinylidene)imidazole-4-carboxamide
SYSTEMATIC NAME: (5Z)-5-(ethylaminohydrazinylidene)imidazole-4-carboxamide
MOLECULAR FORMULA: C6H10N6O
MOLECULAR WEIGHT: 182.1832
SMILES: CCNN/N=C\1/C(=NC=N1)C(=O)N
Structure:
CAS RN: 3413-72-7
CAS Name: (5E)-5-(methylaminohydrazinylidene)-4-imidazolecarboxamide
OPENEYE Name: (5E)-5-(methylaminohydrazono)imidazole-4-carboxamide
IUPAC Name: (5E)-5-(methylaminohydrazinylidene)imidazole-4-carboxamide
SYSTEMATIC NAME: (5E)-5-(methylaminohydrazinylidene)imidazole-4-carboxamide
MOLECULAR FORMULA: C5H8N6O
MOLECULAR WEIGHT: 168.15662
SMILES: CNN/N=C/1\C(=NC=N1)C(=O)N
Structure:
CAS RN: 5325-71-3
CAS Name: [(E)-3-phenylprop-1-enyl]benzene
OPENEYE Name: [(E)-cinnamyl]benzene
IUPAC Name: [(E)-3-phenylprop-1-enyl]benzene
SYSTEMATIC NAME: [(E)-3-phenylprop-1-enyl]benzene
MOLECULAR FORMULA: C15H14
MOLECULAR WEIGHT: 194.27166
SMILES: C1=CC=C(C=C1)C/C=C/C2=CC=CC=C2
Structure:
CAS RN: 3412-44-0
CAS Name: [(E)-3-phenylprop-1-enyl]benzene
OPENEYE Name: [(E)-cinnamyl]benzene
IUPAC Name: [(E)-3-phenylprop-1-enyl]benzene
SYSTEMATIC NAME: [(E)-3-phenylprop-1-enyl]benzene
MOLECULAR FORMULA: C15H14
MOLECULAR WEIGHT: 194.27166
SMILES: C1=CC=C(C=C1)C/C=C/C2=CC=CC=C2
Structure:
CAS RN: 33945-86-7
CAS Name: 2-methyl-1-benzothiophene 1-oxide
OPENEYE Name: 2-methylbenzothiophene 1-oxide
IUPAC Name: 2-methyl-1-benzothiophene 1-oxide
SYSTEMATIC NAME: 2-methyl-1-benzothiophene 1-oxide
MOLECULAR FORMULA: C9H8OS
MOLECULAR WEIGHT: 164.22422
SMILES: CC1=CC2=CC=CC=C2S1=O
Structure:
CAS RN: 33698-87-2
CAS Name: (Z)-3-pentenoic acid
OPENEYE Name: (Z)-pent-3-enoic acid
IUPAC Name: (Z)-pent-3-enoic acid
SYSTEMATIC NAME: (Z)-pent-3-enoic acid
MOLECULAR FORMULA: C5H8O2
MOLECULAR WEIGHT: 100.11582
SMILES: C/C=C\CC(=O)O
Structure:
CAS RN: 33604-10-3
CAS Name: (Z)-3-(2-methyl-2-phenylhydrazinyl)-2-butenoic acid ethyl ester
OPENEYE Name: ethyl (Z)-3-(2-methyl-2-phenyl-hydrazino)but-2-enoate
IUPAC Name: ethyl (Z)-3-(2-methyl-2-phenylhydrazinyl)but-2-enoate
SYSTEMATIC NAME: ethyl (Z)-3-(2-methyl-2-phenyl-hydrazinyl)but-2-enoate
MOLECULAR FORMULA: C13H18N2O2
MOLECULAR WEIGHT: 234.29422
SMILES: CCOC(=O)/C=C(/C)\NN(C)C1=CC=CC=C1
Structure:
CAS RN: 33602-98-1
CAS Name: (3E)-3-[methyl(phenyl)hydrazinylidene]butanoic acid ethyl ester
OPENEYE Name: ethyl (3E)-3-[methyl(phenyl)hydrazono]butanoate
IUPAC Name: ethyl (3E)-3-[methyl(phenyl)hydrazinylidene]butanoate
SYSTEMATIC NAME: ethyl (3E)-3-[methyl(phenyl)hydrazinylidene]butanoate
MOLECULAR FORMULA: C13H18N2O2
MOLECULAR WEIGHT: 234.29422
SMILES: CCOC(=O)C/C(=N/N(C)C1=CC=CC=C1)/C
Structure:
CAS RN: 33602-99-2
CAS Name: (3Z)-3-[methyl(phenyl)hydrazinylidene]butanoic acid ethyl ester
OPENEYE Name: ethyl (3Z)-3-[methyl(phenyl)hydrazono]butanoate
IUPAC Name: ethyl (3Z)-3-[methyl(phenyl)hydrazinylidene]butanoate
SYSTEMATIC NAME: ethyl (3Z)-3-[methyl(phenyl)hydrazinylidene]butanoate
MOLECULAR FORMULA: C13H18N2O2
MOLECULAR WEIGHT: 234.29422
SMILES: CCOC(=O)C/C(=N\N(C)C1=CC=CC=C1)/C
Structure:
CAS RN: 3332-38-5
CAS Name: cyclohexadecaoctaene
OPENEYE Name: cyclohexadecaoctaene
IUPAC Name: cyclohexadecaoctaene
SYSTEMATIC NAME: cyclohexadecaoctaene
MOLECULAR FORMULA: C16H16
MOLECULAR WEIGHT: 208.29824
SMILES: C\1=C/C=C\C=C\C=C/C=C/C=C\C=C\C=C1
Structure:
CAS RN: 3296-43-3
CAS Name: (Z)-6-octadecenoic acid 2,3-bis[(Z)-1-oxooctadec-6-enoxy]propyl ester
OPENEYE Name: 2,3-bis[[(Z)-octadec-6-enoyl]oxy]propyl (Z)-octadec-6-enoate
IUPAC Name: 2,3-bis[[(Z)-octadec-6-enoyl]oxy]propyl (Z)-octadec-6-enoate
SYSTEMATIC NAME: 2,3-bis[[(Z)-octadec-6-enoyl]oxy]propyl (Z)-octadec-6-enoate
MOLECULAR FORMULA: C57H104O6
MOLECULAR WEIGHT: 885.43206
SMILES: CCCCCCCCCCC/C=C\CCCCC(=O)OCC(OC(=O)CCCC/C=C\CCCCCCCCCCC)COC(=O)CCCC/C=C\CCCCCCCCCCC
Structure:
CAS RN: 79218-15-8
CAS Name: (E)-2-butenoic acid tert-butyl ester
OPENEYE Name: tert-butyl (E)-but-2-enoate
IUPAC Name: tert-butyl (E)-but-2-enoate
SYSTEMATIC NAME: tert-butyl (E)-but-2-enoate
MOLECULAR FORMULA: C8H14O2
MOLECULAR WEIGHT: 142.19556
SMILES: C/C=C/C(=O)OC(C)(C)C
Structure:
CAS RN: 32461-38-4
CAS Name: (4Z)-2,3-dimethylhexa-2,4-diene
OPENEYE Name: (4Z)-2,3-dimethylhexa-2,4-diene
IUPAC Name: (4Z)-2,3-dimethylhexa-2,4-diene
SYSTEMATIC NAME: (4Z)-2,3-dimethylhexa-2,4-diene
MOLECULAR FORMULA: C8H14
MOLECULAR WEIGHT: 110.19676
SMILES: C/C=C\C(=C(C)C)C
Structure:
CAS RN: 32317-47-8
CAS Name: (Z)-N,N-dimethyl-2-penten-3-amine
OPENEYE Name: (Z)-N,N-dimethylpent-2-en-3-amine
IUPAC Name: (Z)-N,N-dimethylpent-2-en-3-amine
SYSTEMATIC NAME: (Z)-N,N-dimethylpent-2-en-3-amine
MOLECULAR FORMULA: C7H15N
MOLECULAR WEIGHT: 113.2007
SMILES: CC/C(=C/C)/N(C)C
Structure:
CAS RN: 32228-15-2
CAS Name: 1-methyl-4-[(E)-prop-1-enyl]sulfonylbenzene
OPENEYE Name: 1-methyl-4-[(E)-prop-1-enyl]sulfonyl-benzene
IUPAC Name: 1-methyl-4-[(E)-prop-1-enyl]sulfonylbenzene
SYSTEMATIC NAME: 1-methyl-4-[(E)-prop-1-enyl]sulfonyl-benzene
MOLECULAR FORMULA: C10H12O2S
MOLECULAR WEIGHT: 196.26608
SMILES: C/C=C/S(=O)(=O)C1=CC=C(C=C1)C
Structure:
CAS RN: 31915-94-3
CAS Name: [(1Z)-buta-1,3-dienyl]benzene
OPENEYE Name: [(1Z)-buta-1,3-dienyl]benzene
IUPAC Name: [(1Z)-buta-1,3-dienyl]benzene
SYSTEMATIC NAME: [(1Z)-buta-1,3-dienyl]benzene
MOLECULAR FORMULA: C10H10
MOLECULAR WEIGHT: 130.1864
SMILES: C=C/C=C\C1=CC=CC=C1
Structure:
CAS RN: 31881-17-1
CAS Name: (E)-2-(2,5-dimethylphenyl)-3-(4-nitrophenyl)-2-propenenitrile
OPENEYE Name: (E)-2-(2,5-dimethylphenyl)-3-(4-nitrophenyl)prop-2-enenitrile
IUPAC Name: (E)-2-(2,5-dimethylphenyl)-3-(4-nitrophenyl)prop-2-enenitrile
SYSTEMATIC NAME: (E)-2-(2,5-dimethylphenyl)-3-(4-nitrophenyl)prop-2-enenitrile
MOLECULAR FORMULA: C17H14N2O2
MOLECULAR WEIGHT: 278.30526
SMILES: CC1=CC(=C(C=C1)C)/C(=C\C2=CC=C(C=C2)[N+](=O)[O-])/C#N
Structure:
CAS RN: 31881-16-0
CAS Name: (E)-2-(2,5-dimethylphenyl)-3-(3-nitrophenyl)-2-propenenitrile
OPENEYE Name: (E)-2-(2,5-dimethylphenyl)-3-(3-nitrophenyl)prop-2-enenitrile
IUPAC Name: (E)-2-(2,5-dimethylphenyl)-3-(3-nitrophenyl)prop-2-enenitrile
SYSTEMATIC NAME: (E)-2-(2,5-dimethylphenyl)-3-(3-nitrophenyl)prop-2-enenitrile
MOLECULAR FORMULA: C17H14N2O2
MOLECULAR WEIGHT: 278.30526
SMILES: CC1=CC(=C(C=C1)C)/C(=C\C2=CC(=CC=C2)[N+](=O)[O-])/C#N
Structure:
CAS RN: 31881-14-8
CAS Name: (Z)-2-(2-methylphenyl)-3-(4-nitrophenyl)-2-propenenitrile
OPENEYE Name: (Z)-3-(4-nitrophenyl)-2-(o-tolyl)prop-2-enenitrile
IUPAC Name: (Z)-2-(2-methylphenyl)-3-(4-nitrophenyl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-2-(2-methylphenyl)-3-(4-nitrophenyl)prop-2-enenitrile
MOLECULAR FORMULA: C16H12N2O2
MOLECULAR WEIGHT: 264.27868
SMILES: CC1=CC=CC=C1/C(=C/C2=CC=C(C=C2)[N+](=O)[O-])/C#N
Structure:
CAS RN: 31881-13-7
CAS Name: (Z)-2-(2-methylphenyl)-3-(3-nitrophenyl)-2-propenenitrile
OPENEYE Name: (Z)-3-(3-nitrophenyl)-2-(o-tolyl)prop-2-enenitrile
IUPAC Name: (Z)-2-(2-methylphenyl)-3-(3-nitrophenyl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-2-(2-methylphenyl)-3-(3-nitrophenyl)prop-2-enenitrile
MOLECULAR FORMULA: C16H12N2O2
MOLECULAR WEIGHT: 264.27868
SMILES: CC1=CC=CC=C1/C(=C/C2=CC(=CC=C2)[N+](=O)[O-])/C#N
Structure:
CAS RN: 31881-12-6
CAS Name: (Z)-2-(2-methylphenyl)-3-(2-nitrophenyl)-2-propenenitrile
OPENEYE Name: (Z)-3-(2-nitrophenyl)-2-(o-tolyl)prop-2-enenitrile
IUPAC Name: (Z)-2-(2-methylphenyl)-3-(2-nitrophenyl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-2-(2-methylphenyl)-3-(2-nitrophenyl)prop-2-enenitrile
MOLECULAR FORMULA: C16H12N2O2
MOLECULAR WEIGHT: 264.27868
SMILES: CC1=CC=CC=C1/C(=C/C2=CC=CC=C2[N+](=O)[O-])/C#N
Structure:
CAS RN: 31881-10-4
CAS Name: (Z)-3-(3-chlorophenyl)-2-(2-methylphenyl)-2-propenenitrile
OPENEYE Name: (Z)-3-(3-chlorophenyl)-2-(o-tolyl)prop-2-enenitrile
IUPAC Name: (Z)-3-(3-chlorophenyl)-2-(2-methylphenyl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-(3-chlorophenyl)-2-(2-methylphenyl)prop-2-enenitrile
MOLECULAR FORMULA: C16H12ClN
MOLECULAR WEIGHT: 253.72618
SMILES: CC1=CC=CC=C1/C(=C/C2=CC(=CC=C2)Cl)/C#N
Structure:
CAS RN: 31881-09-1
CAS Name: (Z)-3-(2-chlorophenyl)-2-(2-methylphenyl)-2-propenenitrile
OPENEYE Name: (Z)-3-(2-chlorophenyl)-2-(o-tolyl)prop-2-enenitrile
IUPAC Name: (Z)-3-(2-chlorophenyl)-2-(2-methylphenyl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-(2-chlorophenyl)-2-(2-methylphenyl)prop-2-enenitrile
MOLECULAR FORMULA: C16H12ClN
MOLECULAR WEIGHT: 253.72618
SMILES: CC1=CC=CC=C1/C(=C/C2=CC=CC=C2Cl)/C#N
Structure:
CAS RN: 31110-30-2
CAS Name: (Z)-2-butenamide
OPENEYE Name: (Z)-but-2-enamide
IUPAC Name: (Z)-but-2-enamide
SYSTEMATIC NAME: (Z)-but-2-enamide
MOLECULAR FORMULA: C4H7NO
MOLECULAR WEIGHT: 85.10448
SMILES: C/C=C\C(=O)N
Structure:
CAS RN: 2837-86-7
CAS Name: (E)-1-chloro-1,2-difluoroethene
OPENEYE Name: (E)-1-chloro-1,2-difluoro-ethylene
IUPAC Name: (E)-1-chloro-1,2-difluoroethene
SYSTEMATIC NAME: (E)-1-chloranyl-1,2-bis(fluoranyl)ethene
MOLECULAR FORMULA: C2HClF2
MOLECULAR WEIGHT: 98.479146
SMILES: C(=C(\F)/Cl)\F
Structure:
CAS RN: 30860-28-7
CAS Name: (E)-1-chloro-1,2-difluoroethene
OPENEYE Name: (E)-1-chloro-1,2-difluoro-ethylene
IUPAC Name: (E)-1-chloro-1,2-difluoroethene
SYSTEMATIC NAME: (E)-1-chloranyl-1,2-bis(fluoranyl)ethene
MOLECULAR FORMULA: C2HClF2
MOLECULAR WEIGHT: 98.479146
SMILES: C(=C(\F)/Cl)\F
Structure:
CAS RN: 30834-33-4
CAS Name: 2,3-dichloro-1-benzothiophene 1-oxide
OPENEYE Name: 2,3-dichlorobenzothiophene 1-oxide
IUPAC Name: 2,3-dichloro-1-benzothiophene 1-oxide
SYSTEMATIC NAME: 2,3-bis(chloranyl)-1-benzothiophene 1-oxide
MOLECULAR FORMULA: C8H4Cl2OS
MOLECULAR WEIGHT: 219.08776
SMILES: C1=CC=C2C(=C1)C(=C(S2=O)Cl)Cl
Structure:
CAS RN: 30633-94-4
CAS Name: (6E)-6-[(4-butylanilino)methylidene]-3-methoxy-1-cyclohexa-2,4-dienone
OPENEYE Name: (6E)-6-[(4-butylanilino)methylene]-3-methoxy-cyclohexa-2,4-dien-1-one
IUPAC Name: (6E)-6-[(4-butylanilino)methylidene]-3-methoxycyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6E)-6-[[(4-butylphenyl)amino]methylidene]-3-methoxy-cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C18H21NO2
MOLECULAR WEIGHT: 283.36484
SMILES: CCCCC1=CC=C(C=C1)N/C=C/2\C=CC(=CC2=O)OC
Structure:
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