CAS RN: 19897-64-4
CAS Name: 7-bromo-4-(1-bromopropyl)-2-[(E)-pent-2-en-4-ynyl]-3,9-dioxabicyclo[4.2.1]nonane
OPENEYE Name: 7-bromo-4-(1-bromopropyl)-2-[(E)-pent-2-en-4-ynyl]-3,9-dioxabicyclo[4.2.1]nonane
IUPAC Name: 7-bromo-4-(1-bromopropyl)-2-[(E)-pent-2-en-4-ynyl]-3,9-dioxabicyclo[4.2.1]nonane
SYSTEMATIC NAME: 7-bromanyl-4-(1-bromanylpropyl)-2-[(E)-pent-2-en-4-ynyl]-3,9-dioxabicyclo[4.2.1]nonane
MOLECULAR FORMULA: C15H20Br2O2
MOLECULAR WEIGHT: 392.1261
SMILES: CCC(C1CC2C(CC(O2)C(O1)C/C=C/C#C)Br)Br
Structure:
CAS RN: 3411-09-4
CAS Name: (E)-4-(2,6-dimethoxy-4-pentylphenyl)-3-buten-2-one
OPENEYE Name: (E)-4-(2,6-dimethoxy-4-pentyl-phenyl)but-3-en-2-one
IUPAC Name: (E)-4-(2,6-dimethoxy-4-pentylphenyl)but-3-en-2-one
SYSTEMATIC NAME: (E)-4-(2,6-dimethoxy-4-pentyl-phenyl)but-3-en-2-one
MOLECULAR FORMULA: C17H24O3
MOLECULAR WEIGHT: 276.37066
SMILES: CCCCCC1=CC(=C(C(=C1)OC)/C=C/C(=O)C)OC
Structure:
CAS RN: 1258-63-5
CAS Name: 2-chloro-3-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]naphthalene-1,4-dione
OPENEYE Name: 2-chloro-3-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]naphthalene-1,4-dione
IUPAC Name: 2-chloro-3-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]naphthalene-1,4-dione
SYSTEMATIC NAME: 2-chloranyl-3-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]naphthalene-1,4-dione
MOLECULAR FORMULA: C30H43ClO2
MOLECULAR WEIGHT: 471.11422
SMILES: CC(C)CCCC(C)CCCC(C)CCC/C(=C/CC1=C(C(=O)C2=CC=CC=C2C1=O)Cl)/C
Structure:
CAS RN: 23616-57-1
CAS Name: 3-iodo-1H-pyrrolo[2,3-b]pyridine
OPENEYE Name: 3-iodo-1H-pyrrolo[2,3-b]pyridine
IUPAC Name: 3-iodo-1H-pyrrolo[2,3-b]pyridine
SYSTEMATIC NAME: 3-iodanyl-1H-pyrrolo[2,3-b]pyridine
MOLECULAR FORMULA: C7H5IN2
MOLECULAR WEIGHT: 244.03247
SMILES: C1=CC2=C(NC=C2I)N=C1
Structure:
CAS RN: 5328-73-4
CAS Name: (E)-3-(3-chlorophenyl)-1-phenyl-2-propen-1-one
OPENEYE Name: (E)-3-(3-chlorophenyl)-1-phenyl-prop-2-en-1-one
IUPAC Name: (E)-3-(3-chlorophenyl)-1-phenylprop-2-en-1-one
SYSTEMATIC NAME: (E)-3-(3-chlorophenyl)-1-phenyl-prop-2-en-1-one
MOLECULAR FORMULA: C15H11ClO
MOLECULAR WEIGHT: 242.70024
SMILES: C1=CC=C(C=C1)C(=O)/C=C/C2=CC(=CC=C2)Cl
Structure:
CAS RN: 22966-13-8
CAS Name: (E)-3-(3-chlorophenyl)-1-phenyl-2-propen-1-one
OPENEYE Name: (E)-3-(3-chlorophenyl)-1-phenyl-prop-2-en-1-one
IUPAC Name: (E)-3-(3-chlorophenyl)-1-phenylprop-2-en-1-one
SYSTEMATIC NAME: (E)-3-(3-chlorophenyl)-1-phenyl-prop-2-en-1-one
MOLECULAR FORMULA: C15H11ClO
MOLECULAR WEIGHT: 242.70024
SMILES: C1=CC=C(C=C1)C(=O)/C=C/C2=CC(=CC=C2)Cl
Structure:
CAS RN: 956-04-7
CAS Name: (E)-3-(4-chlorophenyl)-1-phenyl-2-propen-1-one
OPENEYE Name: (E)-3-(4-chlorophenyl)-1-phenyl-prop-2-en-1-one
IUPAC Name: (E)-3-(4-chlorophenyl)-1-phenylprop-2-en-1-one
SYSTEMATIC NAME: (E)-3-(4-chlorophenyl)-1-phenyl-prop-2-en-1-one
MOLECULAR FORMULA: C15H11ClO
MOLECULAR WEIGHT: 242.70024
SMILES: C1=CC=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)Cl
Structure:
CAS RN: 19759-89-8
CAS Name: (E)-1,3-bis(4-chlorophenyl)-2-propen-1-one
OPENEYE Name: (E)-1,3-bis(4-chlorophenyl)prop-2-en-1-one
IUPAC Name: (E)-1,3-bis(4-chlorophenyl)prop-2-en-1-one
SYSTEMATIC NAME: (E)-1,3-bis(4-chlorophenyl)prop-2-en-1-one
MOLECULAR FORMULA: C15H10Cl2O
MOLECULAR WEIGHT: 277.1453
SMILES: C1=CC(=CC=C1/C=C/C(=O)C2=CC=C(C=C2)Cl)Cl
Structure:
CAS RN: 956-02-5
CAS Name: (E)-1-(4-chlorophenyl)-3-phenyl-2-propen-1-one
OPENEYE Name: (E)-1-(4-chlorophenyl)-3-phenyl-prop-2-en-1-one
IUPAC Name: (E)-1-(4-chlorophenyl)-3-phenylprop-2-en-1-one
SYSTEMATIC NAME: (E)-1-(4-chlorophenyl)-3-phenyl-prop-2-en-1-one
MOLECULAR FORMULA: C15H11ClO
MOLECULAR WEIGHT: 242.70024
SMILES: C1=CC=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)Cl
Structure:
CAS RN: 788-24-9
CAS Name: 4-[[(Z)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]benzoic acid
OPENEYE Name: 4-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoic acid
IUPAC Name: 4-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoic acid
SYSTEMATIC NAME: 4-[[(Z)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoic acid
MOLECULAR FORMULA: C14H11NO3
MOLECULAR WEIGHT: 241.24204
SMILES: C1=C/C(=C/NC2=CC=C(C=C2)C(=O)O)/C(=O)C=C1
Structure:
CAS RN: 56048-54-5
CAS Name: (6Z)-6-(3H-1,3-benzothiazol-2-ylidene)-3-methyl-1-cyclohexa-2,4-dienone
OPENEYE Name: (6Z)-6-(3H-1,3-benzothiazol-2-ylidene)-3-methyl-cyclohexa-2,4-dien-1-one
IUPAC Name: (6Z)-6-(3H-1,3-benzothiazol-2-ylidene)-3-methylcyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6Z)-6-(3H-1,3-benzothiazol-2-ylidene)-3-methyl-cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C14H11NOS
MOLECULAR WEIGHT: 241.30824
SMILES: CC1=CC(=O)/C(=C\2/NC3=CC=CC=C3S2)/C=C1
Structure:
CAS RN: 7297-52-1
CAS Name: 4-[(E)-2-(4-nitrophenyl)ethenyl]aniline
OPENEYE Name: 4-[(E)-2-(4-nitrophenyl)vinyl]aniline
IUPAC Name: 4-[(E)-2-(4-nitrophenyl)ethenyl]aniline
SYSTEMATIC NAME: 4-[(E)-2-(4-nitrophenyl)ethenyl]aniline
MOLECULAR FORMULA: C14H12N2O2
MOLECULAR WEIGHT: 240.25728
SMILES: C1=CC(=CC=C1/C=C/C2=CC=C(C=C2)[N+](=O)[O-])N
Structure:
CAS RN: 25515-43-9
CAS Name: (E)-1-(2,4-dihydroxyphenyl)-3-phenyl-2-propen-1-one
OPENEYE Name: (E)-1-(2,4-dihydroxyphenyl)-3-phenyl-prop-2-en-1-one
IUPAC Name: (E)-1-(2,4-dihydroxyphenyl)-3-phenylprop-2-en-1-one
SYSTEMATIC NAME: (E)-1-[2,4-bis(oxidanyl)phenyl]-3-phenyl-prop-2-en-1-one
MOLECULAR FORMULA: C15H12O3
MOLECULAR WEIGHT: 240.25398
SMILES: C1=CC=C(C=C1)/C=C/C(=O)C2=C(C=C(C=C2)O)O
Structure:
CAS RN: 23550-76-7
CAS Name: N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]aniline
OPENEYE Name: N-[(Z)-1,3-benzodioxol-5-ylmethyleneamino]aniline
IUPAC Name: N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]aniline
SYSTEMATIC NAME: N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]aniline
MOLECULAR FORMULA: C14H12N2O2
MOLECULAR WEIGHT: 240.25728
SMILES: C1OC2=C(O1)C=C(C=C2)/C=N\NC3=CC=CC=C3
Structure:
CAS RN: 13057-72-2
CAS Name: 7-hydroxy-3-phenyl-1-benzopyran-4-one
OPENEYE Name: 7-hydroxy-3-phenyl-chromen-4-one
IUPAC Name: 7-hydroxy-3-phenylchromen-4-one
SYSTEMATIC NAME: 7-oxidanyl-3-phenyl-chromen-4-one
MOLECULAR FORMULA: C15H10O3
MOLECULAR WEIGHT: 238.2381
SMILES: C1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)O
Structure:
CAS RN: 52649-02-2
CAS Name: (E)-3-(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)-2-propenoic acid
OPENEYE Name: (E)-3-(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)prop-2-enoic acid
IUPAC Name: (E)-3-(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)prop-2-enoic acid
SYSTEMATIC NAME: (E)-3-(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)prop-2-enoic acid
MOLECULAR FORMULA: C12H15NO4
MOLECULAR WEIGHT: 237.2518
SMILES: CCOC(=O)C1=C(C(=C(N1)C)/C=C/C(=O)O)C
Structure:
CAS RN: 143823-24-9
CAS Name: 1,4-dimethoxy-2-methyl-5-[(E)-2-nitroprop-1-enyl]benzene
OPENEYE Name: 1,4-dimethoxy-2-methyl-5-[(E)-2-nitroprop-1-enyl]benzene
IUPAC Name: 1,4-dimethoxy-2-methyl-5-[(E)-2-nitroprop-1-enyl]benzene
SYSTEMATIC NAME: 1,4-dimethoxy-2-methyl-5-[(E)-2-nitroprop-1-enyl]benzene
MOLECULAR FORMULA: C12H15NO4
MOLECULAR WEIGHT: 237.2518
SMILES: CC1=C(C=C(C(=C1)OC)/C=C(\C)/[N+](=O)[O-])OC
Structure:
CAS RN: 17310-26-8
CAS Name: 3-(phenylhydrazo)-2-indolone
OPENEYE Name: 3-(2-phenylhydrazino)indol-2-one
IUPAC Name: 3-(2-phenylhydrazinyl)indol-2-one
SYSTEMATIC NAME: 3-(2-phenylhydrazinyl)indol-2-one
MOLECULAR FORMULA: C14H11N3O
MOLECULAR WEIGHT: 237.25664
SMILES: C1=CC=C(C=C1)NNC2=C3C=CC=CC3=NC2=O
Structure:
CAS RN: 65400-36-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H9NO3
MOLECULAR WEIGHT: 263.24756
SMILES: C1=CC=C2C(=C1)C3=C4C(=CC(=O)C3=O)C=CNC4=C2O
Structure:
CAS RN: 5432-07-5
CAS Name: (Z)-3-(4-methoxyphenyl)-2-phenyl-2-propenenitrile
OPENEYE Name: (Z)-3-(4-methoxyphenyl)-2-phenyl-prop-2-enenitrile
IUPAC Name: (Z)-3-(4-methoxyphenyl)-2-phenylprop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-(4-methoxyphenyl)-2-phenyl-prop-2-enenitrile
MOLECULAR FORMULA: C16H13NO
MOLECULAR WEIGHT: 235.28052
SMILES: COC1=CC=C(C=C1)/C=C(\C#N)/C2=CC=CC=C2
Structure:
CAS RN: 23866-72-0
CAS Name: 7-hydroxy-4-oxo-1-benzopyran-2-carboxylic acid ethyl ester
OPENEYE Name: ethyl 7-hydroxy-4-oxo-chromene-2-carboxylate
IUPAC Name: ethyl 7-hydroxy-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: ethyl 7-oxidanyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C12H10O5
MOLECULAR WEIGHT: 234.2048
SMILES: CCOC(=O)C1=CC(=O)C2=C(O1)C=C(C=C2)O
Structure:
CAS RN: 57558-64-2
CAS Name: (2E)-2-(phenylmethylene)-3,4-dihydronaphthalen-1-one
OPENEYE Name: (2E)-2-benzylidenetetralin-1-one
IUPAC Name: (2E)-2-benzylidene-3,4-dihydronaphthalen-1-one
SYSTEMATIC NAME: (2E)-2-(phenylmethylidene)-3,4-dihydronaphthalen-1-one
MOLECULAR FORMULA: C17H14O
MOLECULAR WEIGHT: 234.29246
SMILES: C1C/C(=C\C2=CC=CC=C2)/C(=O)C3=CC=CC=C31
Structure:
CAS RN: 1720-32-7
CAS Name: [(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]benzene
OPENEYE Name: [(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]benzene
IUPAC Name: [(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]benzene
SYSTEMATIC NAME: [(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]benzene
MOLECULAR FORMULA: C18H16
MOLECULAR WEIGHT: 232.31964
SMILES: C1=CC=C(C=C1)/C=C/C=C/C=C/C2=CC=CC=C2
Structure:
CAS RN: 12766-16-4
CAS Name: [(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]benzene
OPENEYE Name: [(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]benzene
IUPAC Name: [(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]benzene
SYSTEMATIC NAME: [(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]benzene
MOLECULAR FORMULA: C18H16
MOLECULAR WEIGHT: 232.31964
SMILES: C1=CC=C(C=C1)/C=C/C=C/C=C/C2=CC=CC=C2
Structure:
CAS RN: 18951-46-7
CAS Name: 4-[(E)-2-(4-chlorophenyl)ethenyl]phenol
OPENEYE Name: 4-[(E)-2-(4-chlorophenyl)vinyl]phenol
IUPAC Name: 4-[(E)-2-(4-chlorophenyl)ethenyl]phenol
SYSTEMATIC NAME: 4-[(E)-2-(4-chlorophenyl)ethenyl]phenol
MOLECULAR FORMULA: C14H11ClO
MOLECULAR WEIGHT: 230.68954
SMILES: C1=CC(=CC=C1/C=C/C2=CC=C(C=C2)Cl)O
Structure:
CAS RN: 61294-34-6
CAS Name: (6E)-6-[(2,6-diamino-3-pyridinyl)hydrazinylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: (6E)-6-[(2,6-diamino-3-pyridyl)hydrazono]cyclohexa-2,4-dien-1-one
IUPAC Name: (6E)-6-[(2,6-diaminopyridin-3-yl)hydrazinylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6E)-6-[[2,6-bis(azanyl)pyridin-3-yl]hydrazinylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C11H11N5O
MOLECULAR WEIGHT: 229.23794
SMILES: C1=C/C(=N\NC2=C(N=C(C=C2)N)N)/C(=O)C=C1
Structure:
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