Thursday, June 28, 2012

http://ChemLookup.com Compounds




CAS RN: 10315-85-2
CAS Name: benzoic acid 1,1,1,3,3,3-hexafluoropropan-2-yl ester
OPENEYE Name: [2,2,2-trifluoro-1-(trifluoromethyl)ethyl] benzoate
IUPAC Name: 1,1,1,3,3,3-hexafluoropropan-2-yl benzoate
SYSTEMATIC NAME: 1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl benzoate
MOLECULAR FORMULA: C10H6F6O2
MOLECULAR WEIGHT: 272.143859
SMILES: C1=CC=C(C=C1)C(=O)OC(C(F)(F)F)C(F)(F)F
Structure:

CAS RN: 71721-74-9
CAS Name: 3-phenyl-2-propenoic acid (4-nitrophenyl) ester
OPENEYE Name: (4-nitrophenyl) 3-phenylprop-2-enoate
IUPAC Name: (4-nitrophenyl) 3-phenylprop-2-enoate
SYSTEMATIC NAME: (4-nitrophenyl) 3-phenylprop-2-enoate
MOLECULAR FORMULA: C15H11NO4
MOLECULAR WEIGHT: 269.25214
SMILES: C1=CC=C(C=C1)C=CC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]
Structure:

CAS RN: 10271-81-5
CAS Name: phenylmethanesulfonic acid phenyl ester
OPENEYE Name: phenyl phenylmethanesulfonate
IUPAC Name: phenyl phenylmethanesulfonate
SYSTEMATIC NAME: phenyl phenylmethanesulfonate
MOLECULAR FORMULA: C13H12O3S
MOLECULAR WEIGHT: 248.29758
SMILES: C1=CC=C(C=C1)CS(=O)(=O)OC2=CC=CC=C2
Structure:

CAS RN: 19820-47-4
CAS Name: 2,2-dimethylpropanoic acid (4-methoxyphenyl) ester
OPENEYE Name: (4-methoxyphenyl) 2,2-dimethylpropanoate
IUPAC Name: (4-methoxyphenyl) 2,2-dimethylpropanoate
SYSTEMATIC NAME: (4-methoxyphenyl) 2,2-dimethylpropanoate
MOLECULAR FORMULA: C12H16O3
MOLECULAR WEIGHT: 208.25364
SMILES: CC(C)(C)C(=O)OC1=CC=C(C=C1)OC
Structure:

CAS RN: 63549-55-3
CAS Name: 2,2-dimethylpropanoic acid (4-bromophenyl) ester
OPENEYE Name: (4-bromophenyl) 2,2-dimethylpropanoate
IUPAC Name: (4-bromophenyl) 2,2-dimethylpropanoate
SYSTEMATIC NAME: (4-bromophenyl) 2,2-dimethylpropanoate
MOLECULAR FORMULA: C11H13BrO2
MOLECULAR WEIGHT: 257.12372
SMILES: CC(C)(C)C(=O)OC1=CC=C(C=C1)Br
Structure:

CAS RN: 57025-46-4
CAS Name: 2,2-dimethylpropanoic acid (2-chloro-4-nitrophenyl) ester
OPENEYE Name: (2-chloro-4-nitro-phenyl) 2,2-dimethylpropanoate
IUPAC Name: (2-chloro-4-nitrophenyl) 2,2-dimethylpropanoate
SYSTEMATIC NAME: (2-chloranyl-4-nitro-phenyl) 2,2-dimethylpropanoate
MOLECULAR FORMULA: C11H12ClNO4
MOLECULAR WEIGHT: 257.67028
SMILES: CC(C)(C)C(=O)OC1=C(C=C(C=C1)[N+](=O)[O-])Cl
Structure:

CAS RN: 50727-79-2
CAS Name: 2-amino-3-[3-[(2-amino-2-carboxyethyl)thio]propylthio]propanoic acid
OPENEYE Name: 2-amino-3-[3-(2-amino-2-carboxy-ethyl)sulfanylpropylsulfanyl]propanoic acid
IUPAC Name: 2-amino-3-[3-(2-amino-2-carboxyethyl)sulfanylpropylsulfanyl]propanoic acid
SYSTEMATIC NAME: 2-azanyl-3-[3-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)sulfanylpropylsulfanyl]propanoic acid
MOLECULAR FORMULA: C9H18N2O4S2
MOLECULAR WEIGHT: 282.38022
SMILES: C(CSCC(C(=O)O)N)CSCC(C(=O)O)N
Structure:

CAS RN: 3648-29-1
CAS Name: 4-(dimethylamino)pyridine-2,6-dicarboxylic acid
OPENEYE Name: 4-(dimethylamino)pyridine-2,6-dicarboxylic acid
IUPAC Name: 4-(dimethylamino)pyridine-2,6-dicarboxylic acid
SYSTEMATIC NAME: 4-(dimethylamino)pyridine-2,6-dicarboxylic acid
MOLECULAR FORMULA: C9H10N2O4
MOLECULAR WEIGHT: 210.1867
SMILES: CN(C)C1=CC(=NC(=C1)C(=O)O)C(=O)O
Structure:

CAS RN: 25431-80-5
CAS Name: 2-(2-butan-2-ylidenehydrazinyl)ethanol
OPENEYE Name: 2-[2-(1-methylpropylidene)hydrazino]ethanol
IUPAC Name: 2-(2-butan-2-ylidenehydrazinyl)ethanol
SYSTEMATIC NAME: 2-(2-butan-2-ylidenehydrazinyl)ethanol
MOLECULAR FORMULA: C6H14N2O
MOLECULAR WEIGHT: 130.18816
SMILES: CCC(=NNCCO)C
Structure:

CAS RN: 66052-62-8
CAS Name: 1-(2-chloroethyl)-3-[(1S,2R)-2-hydroxycyclohexyl]-1-nitrosourea
OPENEYE Name: 1-(2-chloroethyl)-3-[(1S,2R)-2-hydroxycyclohexyl]-1-nitroso-urea
IUPAC Name: 1-(2-chloroethyl)-3-[(1S,2R)-2-hydroxycyclohexyl]-1-nitrosourea
SYSTEMATIC NAME: 1-(2-chloroethyl)-1-nitroso-3-[(1S,2R)-2-oxidanylcyclohexyl]urea
MOLECULAR FORMULA: C9H16ClN3O3
MOLECULAR WEIGHT: 249.69464
SMILES: C1CC[C@H]([C@H](C1)NC(=O)N(CCCl)N=O)O
Structure:

CAS RN: 56323-45-6
CAS Name: 1-(2-chloroethyl)-3-[(1S,3R)-3-hydroxycyclohexyl]-1-nitrosourea
OPENEYE Name: 1-(2-chloroethyl)-3-[(1S,3R)-3-hydroxycyclohexyl]-1-nitroso-urea
IUPAC Name: 1-(2-chloroethyl)-3-[(1S,3R)-3-hydroxycyclohexyl]-1-nitrosourea
SYSTEMATIC NAME: 1-(2-chloroethyl)-1-nitroso-3-[(1S,3R)-3-oxidanylcyclohexyl]urea
MOLECULAR FORMULA: C9H16ClN3O3
MOLECULAR WEIGHT: 249.69464
SMILES: C1C[C@@H](C[C@@H](C1)O)NC(=O)N(CCCl)N=O
Structure:

CAS RN: 62102-27-6
CAS Name: 3-ethoxy-N-[[[3-hydroxy-4-(hydroxymethyl)cyclopentyl]amino]-oxomethyl]-2-propenamide
OPENEYE Name: 3-ethoxy-N-[[3-hydroxy-4-(hydroxymethyl)cyclopentyl]carbamoyl]prop-2-enamide
IUPAC Name: 3-ethoxy-N-[[3-hydroxy-4-(hydroxymethyl)cyclopentyl]carbamoyl]prop-2-enamide
SYSTEMATIC NAME: 3-ethoxy-N-[[3-(hydroxymethyl)-4-oxidanyl-cyclopentyl]carbamoyl]prop-2-enamide
MOLECULAR FORMULA: C12H20N2O5
MOLECULAR WEIGHT: 272.2976
SMILES: CCOC=CC(=O)NC(=O)NC1CC(C(C1)O)CO
Structure:

CAS RN: 64395-31-9
CAS Name: 4-(6-aminopurin-9-yl)-2-(hydroxymethyl)-3-oxolanol
OPENEYE Name: 4-(6-aminopurin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-ol
IUPAC Name: 4-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
SYSTEMATIC NAME: 4-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
MOLECULAR FORMULA: C10H13N5O3
MOLECULAR WEIGHT: 251.24192
SMILES: C1C(C(C(O1)CO)O)N2C=NC3=C2N=CN=C3N
Structure:

CAS RN: 72792-79-1
CAS Name: 6-amino-2,5-dimethyl-4-pyrimidinecarboxylic acid
OPENEYE Name: 6-amino-2,5-dimethyl-pyrimidine-4-carboxylic acid
IUPAC Name: 6-amino-2,5-dimethylpyrimidine-4-carboxylic acid
SYSTEMATIC NAME: 6-azanyl-2,5-dimethyl-pyrimidine-4-carboxylic acid
MOLECULAR FORMULA: C7H9N3O2
MOLECULAR WEIGHT: 167.16526
SMILES: CC1=C(N=C(N=C1N)C)C(=O)O
Structure:

CAS RN: 58276-89-4
CAS Name: N-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzamide
OPENEYE Name: N-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]benzamide
IUPAC Name: N-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzamide
SYSTEMATIC NAME: N-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzamide
MOLECULAR FORMULA: C15H11N3O5
MOLECULAR WEIGHT: 313.26494
SMILES: C1OC2=C(O1)C=C(C(=C2)C=NNC(=O)C3=CC=CC=C3)[N+](=O)[O-]
Structure:

CAS RN: 39794-30-4
CAS Name: N-[(3,4-dimethoxyphenyl)methylideneamino]benzamide
OPENEYE Name: N-[(3,4-dimethoxyphenyl)methyleneamino]benzamide
IUPAC Name: N-[(3,4-dimethoxyphenyl)methylideneamino]benzamide
SYSTEMATIC NAME: N-[(3,4-dimethoxyphenyl)methylideneamino]benzamide
MOLECULAR FORMULA: C16H16N2O3
MOLECULAR WEIGHT: 284.30984
SMILES: COC1=C(C=C(C=C1)C=NNC(=O)C2=CC=CC=C2)OC
Structure:

CAS RN: 24744-59-0
CAS Name: 2-(3,5-dibromo-4-hydroxyphenyl)acetic acid ethyl ester
OPENEYE Name: ethyl 2-(3,5-dibromo-4-hydroxy-phenyl)acetate
IUPAC Name: ethyl 2-(3,5-dibromo-4-hydroxyphenyl)acetate
SYSTEMATIC NAME: ethyl 2-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]ethanoate
MOLECULAR FORMULA: C10H10Br2O3
MOLECULAR WEIGHT: 337.9926
SMILES: CCOC(=O)CC1=CC(=C(C(=C1)Br)O)Br
Structure:

CAS RN: 15191-70-5
CAS Name: 1-(9H-fluoren-2-yl)-4,4,4-trifluorobutane-1,3-dione
OPENEYE Name: 1-(9H-fluoren-2-yl)-4,4,4-trifluoro-butane-1,3-dione
IUPAC Name: 1-(9H-fluoren-2-yl)-4,4,4-trifluorobutane-1,3-dione
SYSTEMATIC NAME: 4,4,4-tris(fluoranyl)-1-(9H-fluoren-2-yl)butane-1,3-dione
MOLECULAR FORMULA: C17H11F3O2
MOLECULAR WEIGHT: 304.26325
SMILES: C1C2=CC=CC=C2C3=C1C=C(C=C3)C(=O)CC(=O)C(F)(F)F
Structure:

CAS RN: 581-83-9
CAS Name: 4,4,4-trifluoro-1-(4-phenylphenyl)butane-1,3-dione
OPENEYE Name: 4,4,4-trifluoro-1-(4-phenylphenyl)butane-1,3-dione
IUPAC Name: 4,4,4-trifluoro-1-(4-phenylphenyl)butane-1,3-dione
SYSTEMATIC NAME: 4,4,4-tris(fluoranyl)-1-(4-phenylphenyl)butane-1,3-dione
MOLECULAR FORMULA: C16H11F3O2
MOLECULAR WEIGHT: 292.25255
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CC(=O)C(F)(F)F
Structure:

CAS RN: 1629-75-0
CAS Name: 1,3-benzothiazol-2-yl(phenyl)methanone
OPENEYE Name: 1,3-benzothiazol-2-yl(phenyl)methanone
IUPAC Name: 1,3-benzothiazol-2-yl(phenyl)methanone
SYSTEMATIC NAME: 1,3-benzothiazol-2-yl(phenyl)methanone
MOLECULAR FORMULA: C14H9NOS
MOLECULAR WEIGHT: 239.29236
SMILES: C1=CC=C(C=C1)C(=O)C2=NC3=CC=CC=C3S2
Structure:

CAS RN: 35264-29-0
CAS Name: 4-(hydrazinecarbonyl)benzenesulfonamide
OPENEYE Name: 4-(hydrazinecarbonyl)benzenesulfonamide
IUPAC Name: 4-(hydrazinecarbonyl)benzenesulfonamide
SYSTEMATIC NAME: 4-(aminocarbamoyl)benzenesulfonamide
MOLECULAR FORMULA: C7H9N3O3S
MOLECULAR WEIGHT: 215.22966
SMILES: C1=CC(=CC=C1C(=O)NN)S(=O)(=O)N
Structure:

CAS RN: 53749-89-6
CAS Name: sulfurous acid bis(2,2,2-trifluoroethyl) ester
OPENEYE Name: bis(2,2,2-trifluoroethyl) sulfite
IUPAC Name: bis(2,2,2-trifluoroethyl) sulfite
SYSTEMATIC NAME: bis[2,2,2-tris(fluoranyl)ethyl] sulfite
MOLECULAR FORMULA: C4H4F6O3S
MOLECULAR WEIGHT: 246.128179
SMILES: C(C(F)(F)F)OS(=O)OCC(F)(F)F
Structure:

CAS RN: 28752-20-7
CAS Name: (methoxythio)oxymethane
OPENEYE Name: methoxysulfanyloxymethane
IUPAC Name: methoxysulfanyloxymethane
SYSTEMATIC NAME: methoxysulfanyloxymethane
MOLECULAR FORMULA: C2H6O2S
MOLECULAR WEIGHT: 94.13284
SMILES: COSOC
Structure:

CAS RN: 14112-16-4
CAS Name: 2-bromo-3-hydroperoxy-2,3-dimethylbutane
OPENEYE Name: 2-bromo-3-hydroperoxy-2,3-dimethyl-butane
IUPAC Name: 2-bromo-3-hydroperoxy-2,3-dimethylbutane
SYSTEMATIC NAME: 2-bromanyl-3-(dioxidanyl)-2,3-dimethyl-butane
MOLECULAR FORMULA: C6H13BrO2
MOLECULAR WEIGHT: 197.07022
SMILES: CC(C)(C(C)(C)Br)OO
Structure:

CAS RN: 22752-40-5
CAS Name: tris(3,3-dimethylbut-1-ynyl)phosphine
OPENEYE Name: tris(3,3-dimethylbut-1-ynyl)phosphane
IUPAC Name: tris(3,3-dimethylbut-1-ynyl)phosphane
SYSTEMATIC NAME: tris(3,3-dimethylbut-1-ynyl)phosphane
MOLECULAR FORMULA: C18H27P
MOLECULAR WEIGHT: 274.380741
SMILES: CC(C)(C)C#CP(C#CC(C)(C)C)C#CC(C)(C)C
Structure:

CAS RN: 53799-42-1
CAS Name: 2-phenoxy-4',5'-bis(trifluoromethyl)spiro[1,3,2$l^{5}-benzodioxaphosphole-2,2'-1,3-dioxa-2$l^{5}-phosphacyclopent-4-ene]
OPENEYE Name: 2-phenoxy-4',5'-bis(trifluoromethyl)spiro[1,3,2$l^{5}-benzodioxaphosphole-2,2'-1,3-dioxa-2$l^{5}-phosphacyclopent-4-ene]
IUPAC Name: 2-phenoxy-4',5'-bis(trifluoromethyl)spiro[1,3,2$l^{5}-benzodioxaphosphole-2,2'-1,3-dioxa-2$l^{5}-phosphacyclopent-4-ene]
SYSTEMATIC NAME: 2-phenoxy-4',5'-bis(trifluoromethyl)spiro[1,3,2$l^{5}-benzodioxaphosphole-2,2'-1,3-dioxa-2$l^{5}-phosphacyclopent-4-ene]
MOLECULAR FORMULA: C16H9F6O5P
MOLECULAR WEIGHT: 426.20384
SMILES: C1=CC=C(C=C1)OP23(OC4=CC=CC=C4O2)OC(=C(O3)C(F)(F)F)C(F)(F)F
Structure:

CAS RN: 60049-52-7
CAS Name: 4,5-bis(trifluoromethyl)spiro[1,3-dioxa-2$l^{5}-phosphacyclopent-4-ene-2,1'-2,7,8-trioxa-1$l^{5}-phosphabicyclo[3.2.1]octane]
OPENEYE Name: 4,5-bis(trifluoromethyl)spiro[1,3-dioxa-2$l^{5}-phosphacyclopent-4-ene-2,1'-2,7,8-trioxa-1$l^{5}-phosphabicyclo[3.2.1]octane]
IUPAC Name: 4,5-bis(trifluoromethyl)spiro[1,3-dioxa-2$l^{5}-phosphacyclopent-4-ene-2,1'-2,7,8-trioxa-1$l^{5}-phosphabicyclo[3.2.1]octane]
SYSTEMATIC NAME: 4,5-bis(trifluoromethyl)spiro[1,3-dioxa-2$l^{5}-phosphacyclopent-4-ene-2,1'-2,7,8-trioxa-1$l^{5}-phosphabicyclo[3.2.1]octane]
MOLECULAR FORMULA: C8H7F6O5P
MOLECULAR WEIGHT: 328.10236
SMILES: C1COP23(OCC1O2)OC(=C(O3)C(F)(F)F)C(F)(F)F
Structure:

CAS RN: 56688-45-0
CAS Name: 10,13-dimethyl-3'-methylenespiro[2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-3,5'-oxolane]-2',17-dione
OPENEYE Name: 10,13-dimethyl-3'-methylene-spiro[2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-3,5'-tetrahydrofuran]-2',17-dione
IUPAC Name: 10,13-dimethyl-3'-methylidenespiro[2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-3,5'-oxolane]-2',17-dione
SYSTEMATIC NAME: 10,13-dimethyl-3'-methylidene-spiro[2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-3,5'-oxolane]-2',17-dione
MOLECULAR FORMULA: C23H32O3
MOLECULAR WEIGHT: 356.49838
SMILES: CC12CCC3(CC1CCC4C2CCC5(C4CCC5=O)C)CC(=C)C(=O)O3
Structure:

CAS RN: 54463-81-9
CAS Name: N-methyl-5-phenyl-1H-1,2,4-triazol-3-amine
OPENEYE Name: N-methyl-5-phenyl-1H-1,2,4-triazol-3-amine
IUPAC Name: N-methyl-5-phenyl-1H-1,2,4-triazol-3-amine
SYSTEMATIC NAME: N-methyl-5-phenyl-1H-1,2,4-triazol-3-amine
MOLECULAR FORMULA: C9H10N4
MOLECULAR WEIGHT: 174.2025
SMILES: CNC1=NNC(=N1)C2=CC=CC=C2
Structure:

CAS RN: 5584-69-0
CAS Name: 2,4-dimethyl-2H-furan-5-one
OPENEYE Name: 2,4-dimethyl-2H-furan-5-one
IUPAC Name: 2,4-dimethyl-2H-furan-5-one
SYSTEMATIC NAME: 2,4-dimethyl-2H-furan-5-one
MOLECULAR FORMULA: C6H8O2
MOLECULAR WEIGHT: 112.12652
SMILES: CC1C=C(C(=O)O1)C
Structure:

CAS RN: 74002-74-7
CAS Name: 3-bromo-3,5-dimethyl-2-oxolanone
OPENEYE Name: 3-bromo-3,5-dimethyl-tetrahydrofuran-2-one
IUPAC Name: 3-bromo-3,5-dimethyloxolan-2-one
SYSTEMATIC NAME: 3-bromanyl-3,5-dimethyl-oxolan-2-one
MOLECULAR FORMULA: C6H9BrO2
MOLECULAR WEIGHT: 193.03846
SMILES: CC1CC(C(=O)O1)(C)Br
Structure:

CAS RN: 74002-73-6
CAS Name: 3,5-dimethyl-2-oxo-3-oxolanecarboxylic acid
OPENEYE Name: 3,5-dimethyl-2-oxo-tetrahydrofuran-3-carboxylic acid
IUPAC Name: 3,5-dimethyl-2-oxooxolane-3-carboxylic acid
SYSTEMATIC NAME: 3,5-dimethyl-2-oxidanylidene-oxolane-3-carboxylic acid
MOLECULAR FORMULA: C7H10O4
MOLECULAR WEIGHT: 158.1519
SMILES: CC1CC(C(=O)O1)(C)C(=O)O
Structure:

CAS RN: 74002-72-5
CAS Name: 3,5-dimethyl-2-oxo-3-oxolanecarboxylic acid methyl ester
OPENEYE Name: methyl 3,5-dimethyl-2-oxo-tetrahydrofuran-3-carboxylate
IUPAC Name: methyl 3,5-dimethyl-2-oxooxolane-3-carboxylate
SYSTEMATIC NAME: methyl 3,5-dimethyl-2-oxidanylidene-oxolane-3-carboxylate
MOLECULAR FORMULA: C8H12O4
MOLECULAR WEIGHT: 172.17848
SMILES: CC1CC(C(=O)O1)(C)C(=O)OC
Structure:

CAS RN: 57897-29-7
CAS Name: 7,8,9-trimethoxy-4,5-dihydrobenzo[g][1,2]benzoxazole
OPENEYE Name: 7,8,9-trimethoxy-4,5-dihydrobenzo[g][1,2]benzoxazole
IUPAC Name: 7,8,9-trimethoxy-4,5-dihydrobenzo[g][1,2]benzoxazole
SYSTEMATIC NAME: 7,8,9-trimethoxy-4,5-dihydrobenzo[g][1,2]benzoxazole
MOLECULAR FORMULA: C14H15NO4
MOLECULAR WEIGHT: 261.2732
SMILES: COC1=C(C(=C2C(=C1)CCC3=C2ON=C3)OC)OC
Structure:

CAS RN: 57897-28-6
CAS Name: 7,8,9-trimethoxy-4,5-dihydro-1H-benzo[g]indazole
OPENEYE Name: 7,8,9-trimethoxy-4,5-dihydro-1H-benzo[g]indazole
IUPAC Name: 7,8,9-trimethoxy-4,5-dihydro-1H-benzo[g]indazole
SYSTEMATIC NAME: 7,8,9-trimethoxy-4,5-dihydro-1H-benzo[g]indazole
MOLECULAR FORMULA: C14H16N2O3
MOLECULAR WEIGHT: 260.28844
SMILES: COC1=C(C(=C2C(=C1)CCC3=C2NN=C3)OC)OC
Structure:

CAS RN: 5101-02-0
CAS Name: 6,7,8-trimethoxy-3,4-dihydro-2H-naphthalen-1-one
OPENEYE Name: 6,7,8-trimethoxytetralin-1-one
IUPAC Name: 6,7,8-trimethoxy-3,4-dihydro-2H-naphthalen-1-one
SYSTEMATIC NAME: 6,7,8-trimethoxy-3,4-dihydro-2H-naphthalen-1-one
MOLECULAR FORMULA: C13H16O4
MOLECULAR WEIGHT: 236.26374
SMILES: COC1=C(C(=C2C(=C1)CCCC2=O)OC)OC
Structure:

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