CAS RN: 142759-00-0
CAS Name: 3-(1-oxoundecoxy)-4-(trimethylammonio)butanoate
OPENEYE Name: 4-(trimethylammonio)-3-undecanoyloxy-butanoate
IUPAC Name: 4-(trimethylazaniumyl)-3-undecanoyloxybutanoate
SYSTEMATIC NAME: 4-(trimethylazaniumyl)-3-undecanoyloxy-butanoate
MOLECULAR FORMULA: C18H35NO4
MOLECULAR WEIGHT: 329.4748
SMILES: CCCCCCCCCCC(=O)OC(CC(=O)[O-])C[N+](C)(C)C
Structure:
CAS RN: 142744-29-4
CAS Name: 2-[5-[2-[[5-[(dimethylamino)methyl]-2-furanyl]methylthio]ethylamino]-2,4-dinitroanilino]benzonitrile
OPENEYE Name: 2-[5-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethylamino]-2,4-dinitro-anilino]benzonitrile
IUPAC Name: 2-[5-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethylamino]-2,4-dinitroanilino]benzonitrile
SYSTEMATIC NAME: 2-[[5-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethylamino]-2,4-dinitro-phenyl]amino]benzenecarbonitrile
MOLECULAR FORMULA: C23H24N6O5S
MOLECULAR WEIGHT: 496.53886
SMILES: CN(C)CC1=CC=C(O1)CSCCNC2=C(C=C(C(=C2)NC3=CC=CC=C3C#N)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 142744-28-3
CAS Name: N1-[2-[[5-[(dimethylamino)methyl]-2-furanyl]methylthio]ethyl]-N3-(4-fluorophenyl)-4,6-dinitrobenzene-1,3-diamine
OPENEYE Name: N1-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]-N3-(4-fluorophenyl)-4,6-dinitro-benzene-1,3-diamine
IUPAC Name: 1-N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-3-N-(4-fluorophenyl)-4,6-dinitrobenzene-1,3-diamine
SYSTEMATIC NAME: N1-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-N3-(4-fluorophenyl)-4,6-dinitro-benzene-1,3-diamine
MOLECULAR FORMULA: C22H24FN5O5S
MOLECULAR WEIGHT: 489.519863
SMILES: CN(C)CC1=CC=C(O1)CSCCNC2=C(C=C(C(=C2)NC3=CC=C(C=C3)F)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 142744-27-2
CAS Name: N1-[2-[[5-[(dimethylamino)methyl]-2-furanyl]methylthio]ethyl]-4,6-dinitro-N3-phenylbenzene-1,3-diamine
OPENEYE Name: N1-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]-4,6-dinitro-N3-phenyl-benzene-1,3-diamine
IUPAC Name: 1-N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4,6-dinitro-3-N-phenylbenzene-1,3-diamine
SYSTEMATIC NAME: N1-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4,6-dinitro-N3-phenyl-benzene-1,3-diamine
MOLECULAR FORMULA: C22H25N5O5S
MOLECULAR WEIGHT: 471.5294
SMILES: CN(C)CC1=CC=C(O1)CSCCNC2=C(C=C(C(=C2)NC3=CC=CC=C3)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 142744-26-1
CAS Name: N1-[2-[[5-[(dimethylamino)methyl]-2-furanyl]methylthio]ethyl]-4,6-dinitro-N3-(propan-2-ylideneamino)benzene-1,3-diamine
OPENEYE Name: N1-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]-N3-(isopropylideneamino)-4,6-dinitro-benzene-1,3-diamine
IUPAC Name: 1-N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4,6-dinitro-3-N-(propan-2-ylideneamino)benzene-1,3-diamine
SYSTEMATIC NAME: N1-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4,6-dinitro-N3-(propan-2-ylideneamino)benzene-1,3-diamine
MOLECULAR FORMULA: C19H26N6O5S
MOLECULAR WEIGHT: 450.51194
SMILES: CC(=NNC1=C(C=C(C(=C1)NCCSCC2=CC=C(O2)CN(C)C)[N+](=O)[O-])[N+](=O)[O-])C
Structure:
CAS RN: 142744-24-9
CAS Name: N1-[2-[[5-[(dimethylamino)methyl]-2-furanyl]methylthio]ethyl]-4,6-dinitro-N3-(phenylmethyl)benzene-1,3-diamine
OPENEYE Name: N3-benzyl-N1-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]-4,6-dinitro-benzene-1,3-diamine
IUPAC Name: 3-N-benzyl-1-N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4,6-dinitrobenzene-1,3-diamine
SYSTEMATIC NAME: N1-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4,6-dinitro-N3-(phenylmethyl)benzene-1,3-diamine
MOLECULAR FORMULA: C23H27N5O5S
MOLECULAR WEIGHT: 485.55598
SMILES: CN(C)CC1=CC=C(O1)CSCCNC2=C(C=C(C(=C2)NCC3=CC=CC=C3)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 142744-23-8
CAS Name: N1-[2-[[5-[(dimethylamino)methyl]-2-furanyl]methylthio]ethyl]-4,6-dinitro-N3-(3-pyridinylmethyl)benzene-1,3-diamine
OPENEYE Name: N1-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]-4,6-dinitro-N3-(3-pyridylmethyl)benzene-1,3-diamine
IUPAC Name: 1-N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4,6-dinitro-3-N-(pyridin-3-ylmethyl)benzene-1,3-diamine
SYSTEMATIC NAME: N1-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4,6-dinitro-N3-(pyridin-3-ylmethyl)benzene-1,3-diamine
MOLECULAR FORMULA: C22H26N6O5S
MOLECULAR WEIGHT: 486.54404
SMILES: CN(C)CC1=CC=C(O1)CSCCNC2=C(C=C(C(=C2)NCC3=CN=CC=C3)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 142744-22-7
CAS Name: N3-[2-[[5-[(dimethylamino)methyl]-2-furanyl]methylthio]ethyl]-N1-[3-(4-morpholinyl)propyl]-4,6-dinitrobenzene-1,3-diamine
OPENEYE Name: N3-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]-N1-(3-morpholinopropyl)-4,6-dinitro-benzene-1,3-diamine
IUPAC Name: 3-N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-1-N-(3-morpholin-4-ylpropyl)-4,6-dinitrobenzene-1,3-diamine
SYSTEMATIC NAME: N3-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-N1-(3-morpholin-4-ylpropyl)-4,6-dinitro-benzene-1,3-diamine
MOLECULAR FORMULA: C23H34N6O6S
MOLECULAR WEIGHT: 522.61766
SMILES: CN(C)CC1=CC=C(O1)CSCCNC2=C(C=C(C(=C2)NCCCN3CCOCC3)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 142744-21-6
CAS Name: N1-[2-(dimethylamino)ethyl]-N3-[2-[[5-[(dimethylamino)methyl]-2-furanyl]methylthio]ethyl]-4,6-dinitrobenzene-1,3-diamine
OPENEYE Name: N1-[2-(dimethylamino)ethyl]-N3-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]-4,6-dinitro-benzene-1,3-diamine
IUPAC Name: 1-N-[2-(dimethylamino)ethyl]-3-N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4,6-dinitrobenzene-1,3-diamine
SYSTEMATIC NAME: N1-[2-(dimethylamino)ethyl]-N3-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4,6-dinitro-benzene-1,3-diamine
MOLECULAR FORMULA: C20H30N6O5S
MOLECULAR WEIGHT: 466.5544
SMILES: CN(C)CCNC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NCCSCC2=CC=C(O2)CN(C)C
Structure:
CAS RN: 142744-19-2
CAS Name: N3-[2-[[5-[(dimethylamino)methyl]-2-furanyl]methylthio]ethyl]-4,6-dinitro-N1-propylbenzene-1,3-diamine
OPENEYE Name: N3-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]-4,6-dinitro-N1-propyl-benzene-1,3-diamine
IUPAC Name: 3-N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4,6-dinitro-1-N-propylbenzene-1,3-diamine
SYSTEMATIC NAME: N3-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4,6-dinitro-N1-propyl-benzene-1,3-diamine
MOLECULAR FORMULA: C19H27N5O5S
MOLECULAR WEIGHT: 437.51318
SMILES: CCCNC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NCCSCC2=CC=C(O2)CN(C)C
Structure:
CAS RN: 142744-18-1
CAS Name: N3-[2-[[5-[(dimethylamino)methyl]-2-furanyl]methylthio]ethyl]-N1-methyl-4,6-dinitrobenzene-1,3-diamine
OPENEYE Name: N3-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]-N1-methyl-4,6-dinitro-benzene-1,3-diamine
IUPAC Name: 3-N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-1-N-methyl-4,6-dinitrobenzene-1,3-diamine
SYSTEMATIC NAME: N3-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-N1-methyl-4,6-dinitro-benzene-1,3-diamine
MOLECULAR FORMULA: C17H23N5O5S
MOLECULAR WEIGHT: 409.46002
SMILES: CNC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NCCSCC2=CC=C(O2)CN(C)C
Structure:
CAS RN: 142744-17-0
CAS Name: N3-[2-[[5-[(dimethylamino)methyl]-2-furanyl]methylthio]ethyl]-4,6-dinitrobenzene-1,3-diamine
OPENEYE Name: N3-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]-4,6-dinitro-benzene-1,3-diamine
IUPAC Name: 3-N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4,6-dinitrobenzene-1,3-diamine
SYSTEMATIC NAME: N3-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4,6-dinitro-benzene-1,3-diamine
MOLECULAR FORMULA: C16H21N5O5S
MOLECULAR WEIGHT: 395.43344
SMILES: CN(C)CC1=CC=C(O1)CSCCNC2=C(C=C(C(=C2)N)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 142744-16-9
CAS Name: N-[2-[[5-[(dimethylamino)methyl]-2-furanyl]methylthio]ethyl]-4-fluoro-2-nitroaniline
OPENEYE Name: N-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]-4-fluoro-2-nitro-aniline
IUPAC Name: N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4-fluoro-2-nitroaniline
SYSTEMATIC NAME: N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-4-fluoranyl-2-nitro-aniline
MOLECULAR FORMULA: C16H20FN3O3S
MOLECULAR WEIGHT: 353.411703
SMILES: CN(C)CC1=CC=C(O1)CSCCNC2=C(C=C(C=C2)F)[N+](=O)[O-]
Structure:
CAS RN: 142744-14-7
CAS Name: N-[2-[[5-[(dimethylamino)methyl]-2-furanyl]methylthio]ethyl]-5-fluoro-2,4-dinitroaniline
OPENEYE Name: N-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]-5-fluoro-2,4-dinitro-aniline
IUPAC Name: N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-5-fluoro-2,4-dinitroaniline
SYSTEMATIC NAME: N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-5-fluoranyl-2,4-dinitro-aniline
MOLECULAR FORMULA: C16H19FN4O5S
MOLECULAR WEIGHT: 398.409263
SMILES: CN(C)CC1=CC=C(O1)CSCCNC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])F
Structure:
CAS RN: 142744-13-6
CAS Name: N-[2-[[5-[(dimethylamino)methyl]-2-furanyl]methylthio]ethyl]-2,4-dinitroaniline
OPENEYE Name: N-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]-2,4-dinitro-aniline
IUPAC Name: N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-2,4-dinitroaniline
SYSTEMATIC NAME: N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-2,4-dinitro-aniline
MOLECULAR FORMULA: C16H20N4O5S
MOLECULAR WEIGHT: 380.4188
SMILES: CN(C)CC1=CC=C(O1)CSCCNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 142735-55-5
CAS Name: (2S,3R,4S,5R,6R)-2-[[(10R,13S,16R,17R)-3-hydroxy-17-[(2S)-3-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-1-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-16-yl]oxy]-
OPENEYE Name: (2S,3R,4S,5R,6R)-2-[[(10R,13S,16R,17R)-3-hydroxy-17-[(1S)-2-hydroxy-1,5-dimethyl-hexyl]-10,13-dimethyl-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-16-
IUPAC Name: (2S,3R,4S,5R,6R)-2-[[(10R,13S,16R,17R)-3-hydroxy-17-[(2S)-3-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-16-yl]oxy]-6-
SYSTEMATIC NAME: (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-[[(10R,13S,16R,17R)-1-[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-10,13-dimethyl-17-[(2S)-6-methyl-3-oxidanyl-heptan-2-yl]-3-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]
MOLECULAR FORMULA: C39H66O14
MOLECULAR WEIGHT: 758.93294
SMILES: C[C@@H]([C@H]1[C@@H](CC2[C@@]1(CCC3C2CC=C4[C@@]3(C(CC(C4)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)C)C)O[C@@H]6[C@@H]([C@H]([C@H]([C@H](O6)CO)O)O)O)C(CCC(C)C)O
Structure:
CAS RN: 142735-31-7
CAS Name: 1-[4-(4-phenyl-1-piperazinyl)butyl]-2-oxazolo[5,4-b]pyridinone
OPENEYE Name: 1-[4-(4-phenylpiperazin-1-yl)butyl]oxazolo[5,4-b]pyridin-2-one
IUPAC Name: 1-[4-(4-phenylpiperazin-1-yl)butyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
SYSTEMATIC NAME: 1-[4-(4-phenylpiperazin-1-yl)butyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
MOLECULAR FORMULA: C20H24N4O2
MOLECULAR WEIGHT: 352.43016
SMILES: C1CN(CCN1CCCCN2C3=C(N=CC=C3)OC2=O)C4=CC=CC=C4
Structure:
CAS RN: 142714-74-7
CAS Name: 1-(4-bromobutyl)-2-oxazolo[5,4-b]pyridinone
OPENEYE Name: 1-(4-bromobutyl)oxazolo[5,4-b]pyridin-2-one
IUPAC Name: 1-(4-bromobutyl)-[1,3]oxazolo[5,4-b]pyridin-2-one
SYSTEMATIC NAME: 1-(4-bromanylbutyl)-[1,3]oxazolo[5,4-b]pyridin-2-one
MOLECULAR FORMULA: C10H11BrN2O2
MOLECULAR WEIGHT: 271.11054
SMILES: C1=CC2=C(N=C1)OC(=O)N2CCCCBr
Structure:
CAS RN: 142714-73-6
CAS Name: 1-(3-bromopropyl)-2-oxazolo[5,4-b]pyridinone
OPENEYE Name: 1-(3-bromopropyl)oxazolo[5,4-b]pyridin-2-one
IUPAC Name: 1-(3-bromopropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one
SYSTEMATIC NAME: 1-(3-bromanylpropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one
MOLECULAR FORMULA: C9H9BrN2O2
MOLECULAR WEIGHT: 257.08396
SMILES: C1=CC2=C(N=C1)OC(=O)N2CCCBr
Structure:
CAS RN: 142714-68-9
CAS Name: 1-[3-(4-phenyl-1-piperazinyl)propyl]-2-oxazolo[5,4-b]pyridinone
OPENEYE Name: 1-[3-(4-phenylpiperazin-1-yl)propyl]oxazolo[5,4-b]pyridin-2-one
IUPAC Name: 1-[3-(4-phenylpiperazin-1-yl)propyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
SYSTEMATIC NAME: 1-[3-(4-phenylpiperazin-1-yl)propyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
MOLECULAR FORMULA: C19H22N4O2
MOLECULAR WEIGHT: 338.40358
SMILES: C1CN(CCN1CCCN2C3=C(N=CC=C3)OC2=O)C4=CC=CC=C4
Structure:
CAS RN: 142714-62-3
CAS Name: 1-[2-[4-(4-fluorophenyl)-1-piperazinyl]ethyl]-2-oxazolo[5,4-b]pyridinone
OPENEYE Name: 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]oxazolo[5,4-b]pyridin-2-one
IUPAC Name: 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
SYSTEMATIC NAME: 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
MOLECULAR FORMULA: C18H19FN4O2
MOLECULAR WEIGHT: 342.367463
SMILES: C1CN(CCN1CCN2C3=C(N=CC=C3)OC2=O)C4=CC=C(C=C4)F
Structure:
CAS RN: 142689-12-1
CAS Name: 6,8-dihydroxy-3,5-dimethyl-4-(trifluoromethyl)-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid
OPENEYE Name: 6,8-dihydroxy-3,5-dimethyl-4-(trifluoromethyl)isochromane-7-carboxylic acid
IUPAC Name: 6,8-dihydroxy-3,5-dimethyl-4-(trifluoromethyl)-3,4-dihydro-1H-isochromene-7-carboxylic acid
SYSTEMATIC NAME: 3,5-dimethyl-6,8-bis(oxidanyl)-4-(trifluoromethyl)-3,4-dihydro-1H-isochromene-7-carboxylic acid
MOLECULAR FORMULA: C13H13F3O5
MOLECULAR WEIGHT: 306.23453
SMILES: CC1C(C2=C(CO1)C(=C(C(=C2C)O)C(=O)O)O)C(F)(F)F
Structure:
CAS RN: 142689-11-0
CAS Name: 7-(dihydroxymethylidene)-3,5-dimethyl-4-(trifluoromethyl)-3,4-dihydro-2-benzopyran-6,8-dione
OPENEYE Name: 7-(dihydroxymethylene)-3,5-dimethyl-4-(trifluoromethyl)-3,4-dihydroisochromene-6,8-dione
IUPAC Name: 7-(dihydroxymethylidene)-3,5-dimethyl-4-(trifluoromethyl)-3,4-dihydroisochromene-6,8-dione
SYSTEMATIC NAME: 7-[bis(oxidanyl)methylidene]-3,5-dimethyl-4-(trifluoromethyl)-3,4-dihydroisochromene-6,8-dione
MOLECULAR FORMULA: C13H11F3O5
MOLECULAR WEIGHT: 304.21865
SMILES: CC1C(C2=C(C(=O)C(=C(O)O)C(=O)C2=CO1)C)C(F)(F)F
Structure:
CAS RN: 142689-10-9
CAS Name: 5-chloro-6,8-dihydroxy-3-(1,1,2,2,2-pentafluoroethyl)-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid
OPENEYE Name: 5-chloro-6,8-dihydroxy-3-(1,1,2,2,2-pentafluoroethyl)isochromane-7-carboxylic acid
IUPAC Name: 5-chloro-6,8-dihydroxy-3-(1,1,2,2,2-pentafluoroethyl)-3,4-dihydro-1H-isochromene-7-carboxylic acid
SYSTEMATIC NAME: 5-chloranyl-6,8-bis(oxidanyl)-3-[1,1,2,2,2-pentakis(fluoranyl)ethyl]-3,4-dihydro-1H-isochromene-7-carboxylic acid
MOLECULAR FORMULA: C12H8ClF5O5
MOLECULAR WEIGHT: 362.633936
SMILES: C1C(OCC2=C1C(=C(C(=C2O)C(=O)O)O)Cl)C(C(F)(F)F)(F)F
Structure:
CAS RN: 142689-09-6
CAS Name: 5-chloro-7-(dihydroxymethylidene)-3-(1,1,2,2,2-pentafluoroethyl)-3,4-dihydro-2-benzopyran-6,8-dione
OPENEYE Name: 5-chloro-7-(dihydroxymethylene)-3-(1,1,2,2,2-pentafluoroethyl)-3,4-dihydroisochromene-6,8-dione
IUPAC Name: 5-chloro-7-(dihydroxymethylidene)-3-(1,1,2,2,2-pentafluoroethyl)-3,4-dihydroisochromene-6,8-dione
SYSTEMATIC NAME: 7-[bis(oxidanyl)methylidene]-5-chloranyl-3-[1,1,2,2,2-pentakis(fluoranyl)ethyl]-3,4-dihydroisochromene-6,8-dione
MOLECULAR FORMULA: C12H6ClF5O5
MOLECULAR WEIGHT: 360.618056
SMILES: C1C(OC=C2C1=C(C(=O)C(=C(O)O)C2=O)Cl)C(C(F)(F)F)(F)F
Structure:
CAS RN: 142689-08-5
CAS Name: 5-bromo-6,8-dihydroxy-3,4-dimethyl-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid
OPENEYE Name: 5-bromo-6,8-dihydroxy-3,4-dimethyl-isochromane-7-carboxylic acid
IUPAC Name: 5-bromo-6,8-dihydroxy-3,4-dimethyl-3,4-dihydro-1H-isochromene-7-carboxylic acid
SYSTEMATIC NAME: 5-bromanyl-3,4-dimethyl-6,8-bis(oxidanyl)-3,4-dihydro-1H-isochromene-7-carboxylic acid
MOLECULAR FORMULA: C12H13BrO5
MOLECULAR WEIGHT: 317.13262
SMILES: CC1C(OCC2=C1C(=C(C(=C2O)C(=O)O)O)Br)C
Structure:
CAS RN: 142689-07-4
CAS Name: 5-bromo-7-(dihydroxymethylidene)-3,4-dimethyl-3,4-dihydro-2-benzopyran-6,8-dione
OPENEYE Name: 5-bromo-7-(dihydroxymethylene)-3,4-dimethyl-3,4-dihydroisochromene-6,8-dione
IUPAC Name: 5-bromo-7-(dihydroxymethylidene)-3,4-dimethyl-3,4-dihydroisochromene-6,8-dione
SYSTEMATIC NAME: 7-[bis(oxidanyl)methylidene]-5-bromanyl-3,4-dimethyl-3,4-dihydroisochromene-6,8-dione
MOLECULAR FORMULA: C12H11BrO5
MOLECULAR WEIGHT: 315.11674
SMILES: CC1C(OC=C2C1=C(C(=O)C(=C(O)O)C2=O)Br)C
Structure:
CAS RN: 142689-06-3
CAS Name: 5-fluoro-6,8-dihydroxy-3,4-dimethyl-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid
OPENEYE Name: 5-fluoro-6,8-dihydroxy-3,4-dimethyl-isochromane-7-carboxylic acid
IUPAC Name: 5-fluoro-6,8-dihydroxy-3,4-dimethyl-3,4-dihydro-1H-isochromene-7-carboxylic acid
SYSTEMATIC NAME: 5-fluoranyl-3,4-dimethyl-6,8-bis(oxidanyl)-3,4-dihydro-1H-isochromene-7-carboxylic acid
MOLECULAR FORMULA: C12H13FO5
MOLECULAR WEIGHT: 256.227023
SMILES: CC1C(OCC2=C1C(=C(C(=C2O)C(=O)O)O)F)C
Structure:
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