CAS RN: 94713-19-6
CAS Name: 4-(4,7-dimethyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-5-yl)-2-methyl-1-cyclohexanol
OPENEYE Name: 4-(4,7-dimethyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-5-yl)-2-methyl-cyclohexanol
IUPAC Name: 4-(4,7-dimethyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-5-yl)-2-methylcyclohexan-1-ol
SYSTEMATIC NAME: 4-(4,7-dimethyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-5-yl)-2-methyl-cyclohexan-1-ol
MOLECULAR FORMULA: C18H32O
MOLECULAR WEIGHT: 264.44608
SMILES: CC1CC(CCC1O)C2CC(C3CCCC3C2C)C
Structure:
CAS RN: 94713-18-5
CAS Name: 4-(4,7-dimethyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-5-yl)-2-methyl-1-cyclohexanone
OPENEYE Name: 4-(4,7-dimethyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-5-yl)-2-methyl-cyclohexanone
IUPAC Name: 4-(4,7-dimethyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-5-yl)-2-methylcyclohexan-1-one
SYSTEMATIC NAME: 4-(4,7-dimethyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-5-yl)-2-methyl-cyclohexan-1-one
MOLECULAR FORMULA: C18H30O
MOLECULAR WEIGHT: 262.4302
SMILES: CC1CC(C(C2C1CCC2)C)C3CCC(=O)C(C3)C
Structure:
CAS RN: 94442-15-6
CAS Name: N-ethyl-3-methyl-4-[(5-nitro-2-thiazolyl)azo]-N-[2-(1-pyridin-1-iumyl)ethyl]aniline chloride
OPENEYE Name: N-ethyl-3-methyl-4-(5-nitrothiazol-2-yl)azo-N-(2-pyridin-1-ium-1-ylethyl)aniline chloride
IUPAC Name: N-ethyl-3-methyl-4-[(5-nitro-1,3-thiazol-2-yl)diazenyl]-N-(2-pyridin-1-ium-1-ylethyl)aniline chloride
SYSTEMATIC NAME: N-ethyl-3-methyl-4-[(5-nitro-1,3-thiazol-2-yl)diazenyl]-N-(2-pyridin-1-ium-1-ylethyl)aniline chloride
MOLECULAR FORMULA: C19H21ClN6O2S
MOLECULAR WEIGHT: 432.92704
SMILES: CCN(CC[N+]1=CC=CC=C1)C2=CC(=C(C=C2)N=NC3=NC=C(S3)[N+](=O)[O-])C.[Cl-]
Structure:
CAS RN: 94442-14-5
CAS Name: 2-ethoxy-8-ethyl-5-oxo-6-pyrido[2,3-d]pyrimidinecarboxylic acid methyl ester
OPENEYE Name: methyl 2-ethoxy-8-ethyl-5-oxo-pyrido[2,3-d]pyrimidine-6-carboxylate
IUPAC Name: methyl 2-ethoxy-8-ethyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxylate
SYSTEMATIC NAME: methyl 2-ethoxy-8-ethyl-5-oxidanylidene-pyrido[2,3-d]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C13H15N3O4
MOLECULAR WEIGHT: 277.2759
SMILES: CCN1C=C(C(=O)C2=CN=C(N=C21)OCC)C(=O)OC
Structure:
CAS RN: 94333-33-2
CAS Name: [2-hydroxy-3-[1-[1-tridecoxy-3-(trimethylammonio)propan-2-yl]oxy-3-(trimethylammonio)propan-2-yl]oxypropyl]-trimethylammonium trichloride
OPENEYE Name: [2-hydroxy-3-[1-[[1-(tridecoxymethyl)-2-(trimethylammonio)ethoxy]methyl]-2-(trimethylammonio)ethoxy]propyl]-trimethyl-ammonium trichloride
IUPAC Name: [2-hydroxy-3-[1-[1-tridecoxy-3-(trimethylazaniumyl)propan-2-yl]oxy-3-(trimethylazaniumyl)propan-2-yl]oxypropyl]-trimethylazanium trichloride
SYSTEMATIC NAME: trimethyl-[2-oxidanyl-3-[1-[1-tridecoxy-3-(trimethylazaniumyl)propan-2-yl]oxy-3-(trimethylazaniumyl)propan-2-yl]oxy-propyl]azanium trichloride
MOLECULAR FORMULA: C31H70Cl3N3O4
MOLECULAR WEIGHT: 655.2642
SMILES: CCCCCCCCCCCCCOCC(C[N+](C)(C)C)OCC(C[N+](C)(C)C)OCC(C[N+](C)(C)C)O.[Cl-].[Cl-].[Cl-]
Structure:
CAS RN: 94291-58-4
CAS Name: 1-(2,4-dimethyl-1-cyclohex-3-enyl)-2,2-dimethyl-1-propanol
OPENEYE Name: 1-(2,4-dimethylcyclohex-3-en-1-yl)-2,2-dimethyl-propan-1-ol
IUPAC Name: 1-(2,4-dimethylcyclohex-3-en-1-yl)-2,2-dimethylpropan-1-ol
SYSTEMATIC NAME: 1-(2,4-dimethylcyclohex-3-en-1-yl)-2,2-dimethyl-propan-1-ol
MOLECULAR FORMULA: C13H24O
MOLECULAR WEIGHT: 196.32906
SMILES: CC1C=C(CCC1C(C(C)(C)C)O)C
Structure:
CAS RN: 94277-28-8
CAS Name: 3-prop-2-enyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-ol
OPENEYE Name: 3-allyldecalin-1-ol
IUPAC Name: 3-prop-2-enyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-ol
SYSTEMATIC NAME: 3-prop-2-enyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-ol
MOLECULAR FORMULA: C13H22O
MOLECULAR WEIGHT: 194.31318
SMILES: C=CCC1CC2CCCCC2C(C1)O
Structure:
CAS RN: 94276-03-6
CAS Name: 1-(1-benzimidazolyl)-2-pentanamine dihydrochloride
OPENEYE Name: 1-(benzimidazol-1-yl)pentan-2-amine dihydrochloride
IUPAC Name: 1-(benzimidazol-1-yl)pentan-2-amine dihydrochloride
SYSTEMATIC NAME: 1-(benzimidazol-1-yl)pentan-2-amine dihydrochloride
MOLECULAR FORMULA: C12H19Cl2N3
MOLECULAR WEIGHT: 276.20536
SMILES: CCCC(CN1C=NC2=CC=CC=C21)N.Cl.Cl
Structure:
CAS RN: 94275-87-3
CAS Name: 2-methyl-2-propenoate; titanium(4+)
OPENEYE Name: 2-methylprop-2-enoate; titanium(4+)
IUPAC Name: 2-methylprop-2-enoate; titanium(4+)
SYSTEMATIC NAME: 2-methylprop-2-enoate; titanium(4+)
MOLECULAR FORMULA: C4H5O2Ti+3
MOLECULAR WEIGHT: 132.9483
SMILES: CC(=C)C(=O)[O-].[Ti+4]
Structure:
CAS RN: 94275-84-0
CAS Name: 7-(diethylamino)-3-(1,3-dimethyl-1,2-dihydrobenzimidazol-1-ium-2-yl)-1-benzopyran-2-one acetate
OPENEYE Name: 7-(diethylamino)-3-(1,3-dimethyl-1,2-dihydrobenzimidazol-1-ium-2-yl)chromen-2-one acetate
IUPAC Name: 7-(diethylamino)-3-(1,3-dimethyl-1,2-dihydrobenzimidazol-1-ium-2-yl)chromen-2-one acetate
SYSTEMATIC NAME: 7-(diethylamino)-3-(1,3-dimethyl-1,2-dihydrobenzimidazol-1-ium-2-yl)chromen-2-one ethanoate
MOLECULAR FORMULA: C24H29N3O4
MOLECULAR WEIGHT: 423.50476
SMILES: CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3[NH+](C4=CC=CC=C4N3C)C.CC(=O)[O-]
Structure:
CAS RN: 94275-72-6
CAS Name: 2-propenoate; tin(2+)
OPENEYE Name: stannous prop-2-enoate
IUPAC Name: prop-2-enoate; tin(2+)
SYSTEMATIC NAME: prop-2-enoate; tin(2+)
MOLECULAR FORMULA: C3H3O2Sn+
MOLECULAR WEIGHT: 189.76472
SMILES: C=CC(=O)[O-].[Sn+2]
Structure:
CAS RN: 94231-52-4
CAS Name: 1-(2-methoxyethyl)-2,5,5,8a-tetramethyl-1,2,3,4,4a,6,7,8-octahydronaphthalene
OPENEYE Name: 5-(2-methoxyethyl)-1,1,4a,6-tetramethyl-decalin
IUPAC Name: 1-(2-methoxyethyl)-2,5,5,8a-tetramethyl-1,2,3,4,4a,6,7,8-octahydronaphthalene
SYSTEMATIC NAME: 1-(2-methoxyethyl)-2,5,5,8a-tetramethyl-1,2,3,4,4a,6,7,8-octahydronaphthalene
MOLECULAR FORMULA: C17H32O
MOLECULAR WEIGHT: 252.43538
SMILES: CC1CCC2C(CCCC2(C1CCOC)C)(C)C
Structure:
CAS RN: 94230-98-5
CAS Name: 5-chloro-2-(2,4-dichlorophenoxy)phenolate; tetraphenylphosphonium
OPENEYE Name: 5-chloro-2-(2,4-dichlorophenoxy)phenolate; tetraphenylphosphonium
IUPAC Name: 5-chloro-2-(2,4-dichlorophenoxy)phenolate; tetraphenylphosphanium
SYSTEMATIC NAME: 2-[2,4-bis(chloranyl)phenoxy]-5-chloranyl-phenolate; tetraphenylphosphanium
MOLECULAR FORMULA: C36H26Cl3O2P
MOLECULAR WEIGHT: 627.923201
SMILES: C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C1=CC(=C(C=C1Cl)[O-])OC2=C(C=C(C=C2)Cl)Cl
Structure:
CAS RN: 94201-65-7
CAS Name: acetic acid [2,2-dimethyl-1-(2,4,6-trimethyl-1-cyclohex-3-enyl)propyl] ester
OPENEYE Name: [2,2-dimethyl-1-(2,4,6-trimethylcyclohex-3-en-1-yl)propyl] acetate
IUPAC Name: [2,2-dimethyl-1-(2,4,6-trimethylcyclohex-3-en-1-yl)propyl] acetate
SYSTEMATIC NAME: [2,2-dimethyl-1-(2,4,6-trimethylcyclohex-3-en-1-yl)propyl] ethanoate
MOLECULAR FORMULA: C16H28O2
MOLECULAR WEIGHT: 252.39232
SMILES: CC1CC(=CC(C1C(C(C)(C)C)OC(=O)C)C)C
Structure:
CAS RN: 94201-38-4
CAS Name: (E)-5-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)-4-pentenal
OPENEYE Name: (E)-5-(3,3-dimethylnorbornan-2-yl)pent-4-enal
IUPAC Name: (E)-5-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)pent-4-enal
SYSTEMATIC NAME: (E)-5-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)pent-4-enal
MOLECULAR FORMULA: C14H22O
MOLECULAR WEIGHT: 206.32388
SMILES: CC1(C2CCC(C2)C1/C=C/CCC=O)C
Structure:
CAS RN: 94201-21-5
CAS Name: acetic acid (1,1,6,6a-tetramethyl-2,4,5,6,7,7a-hexahydro-1aH-cyclopropa[b]naphthalen-4-yl) ester
OPENEYE Name: (1,1,6,6a-tetramethyl-2,4,5,6,7,7a-hexahydro-1aH-cyclopropa[b]naphthalen-4-yl) acetate
IUPAC Name: (1,1,6,6a-tetramethyl-2,4,5,6,7,7a-hexahydro-1aH-cyclopropa[b]naphthalen-4-yl) acetate
SYSTEMATIC NAME: (1,1,6,6a-tetramethyl-2,4,5,6,7,7a-hexahydro-1aH-cyclopropa[b]naphthalen-4-yl) ethanoate
MOLECULAR FORMULA: C17H26O2
MOLECULAR WEIGHT: 262.38714
SMILES: CC1CC(C=C2C1(CC3C(C2)C3(C)C)C)OC(=O)C
Structure:
CAS RN: 94201-14-6
CAS Name: (E)-4-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)-2-methyl-2-buten-1-ol
OPENEYE Name: (E)-4-(3,3-dimethylnorbornan-2-yl)-2-methyl-but-2-en-1-ol
IUPAC Name: (E)-4-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)-2-methylbut-2-en-1-ol
SYSTEMATIC NAME: (E)-4-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)-2-methyl-but-2-en-1-ol
MOLECULAR FORMULA: C14H24O
MOLECULAR WEIGHT: 208.33976
SMILES: C/C(=C\CC1C2CCC(C2)C1(C)C)/CO
Structure:
CAS RN: 94201-02-2
CAS Name: acetic acid [3-methyl-1-(2,4,6-trimethyl-1-cyclohex-3-enyl)but-3-enyl] ester
OPENEYE Name: [3-methyl-1-(2,4,6-trimethylcyclohex-3-en-1-yl)but-3-enyl] acetate
IUPAC Name: [3-methyl-1-(2,4,6-trimethylcyclohex-3-en-1-yl)but-3-enyl] acetate
SYSTEMATIC NAME: [3-methyl-1-(2,4,6-trimethylcyclohex-3-en-1-yl)but-3-enyl] ethanoate
MOLECULAR FORMULA: C16H26O2
MOLECULAR WEIGHT: 250.37644
SMILES: CC1CC(=CC(C1C(CC(=C)C)OC(=O)C)C)C
Structure:
CAS RN: 94200-98-3
CAS Name: 2-methyl-3-(3-methyl-6-propan-2-yl-1-cyclohexenyl)-1-propanol
OPENEYE Name: 3-(6-isopropyl-3-methyl-cyclohexen-1-yl)-2-methyl-propan-1-ol
IUPAC Name: 2-methyl-3-(3-methyl-6-propan-2-ylcyclohexen-1-yl)propan-1-ol
SYSTEMATIC NAME: 2-methyl-3-(3-methyl-6-propan-2-yl-cyclohexen-1-yl)propan-1-ol
MOLECULAR FORMULA: C14H26O
MOLECULAR WEIGHT: 210.35564
SMILES: CC1CCC(C(=C1)CC(C)CO)C(C)C
Structure:
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