CAS RN: 92630-46-1
CAS Name: 1-(4-bromophenyl)-3-phenyl-2-phenyliminopropane-1,3-dione
OPENEYE Name: 1-(4-bromophenyl)-3-phenyl-2-phenylimino-propane-1,3-dione
IUPAC Name: 1-(4-bromophenyl)-3-phenyl-2-phenyliminopropane-1,3-dione
SYSTEMATIC NAME: 1-(4-bromophenyl)-3-phenyl-2-phenylimino-propane-1,3-dione
MOLECULAR FORMULA: C21H14BrNO2
MOLECULAR WEIGHT: 392.24536
SMILES: C1=CC=C(C=C1)C(=O)C(=NC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)Br
Structure:
CAS RN: 92630-45-0
CAS Name: 1-(4-chlorophenyl)-3-phenyl-2-phenyliminopropane-1,3-dione
OPENEYE Name: 1-(4-chlorophenyl)-3-phenyl-2-phenylimino-propane-1,3-dione
IUPAC Name: 1-(4-chlorophenyl)-3-phenyl-2-phenyliminopropane-1,3-dione
SYSTEMATIC NAME: 1-(4-chlorophenyl)-3-phenyl-2-phenylimino-propane-1,3-dione
MOLECULAR FORMULA: C21H14ClNO2
MOLECULAR WEIGHT: 347.79436
SMILES: C1=CC=C(C=C1)C(=O)C(=NC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)Cl
Structure:
CAS RN: 92630-44-9
CAS Name: 1-phenyl-2-phenylimino-3-(4-phenylphenyl)propane-1,3-dione
OPENEYE Name: 1-phenyl-2-phenylimino-3-(4-phenylphenyl)propane-1,3-dione
IUPAC Name: 1-phenyl-2-phenylimino-3-(4-phenylphenyl)propane-1,3-dione
SYSTEMATIC NAME: 1-phenyl-2-phenylimino-3-(4-phenylphenyl)propane-1,3-dione
MOLECULAR FORMULA: C27H19NO2
MOLECULAR WEIGHT: 389.44526
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C(=NC3=CC=CC=C3)C(=O)C4=CC=CC=C4
Structure:
CAS RN: 92630-43-8
CAS Name: 1-(4-methylphenyl)-3-phenyl-2-phenyliminopropane-1,3-dione
OPENEYE Name: 1-phenyl-2-phenylimino-3-(p-tolyl)propane-1,3-dione
IUPAC Name: 1-(4-methylphenyl)-3-phenyl-2-phenyliminopropane-1,3-dione
SYSTEMATIC NAME: 1-(4-methylphenyl)-3-phenyl-2-phenylimino-propane-1,3-dione
MOLECULAR FORMULA: C22H17NO2
MOLECULAR WEIGHT: 327.37588
SMILES: CC1=CC=C(C=C1)C(=O)C(=NC2=CC=CC=C2)C(=O)C3=CC=CC=C3
Structure:
CAS RN: 92630-42-7
CAS Name: 1-(4-methoxyphenyl)-3-phenyl-2-phenyliminopropane-1,3-dione
OPENEYE Name: 1-(4-methoxyphenyl)-3-phenyl-2-phenylimino-propane-1,3-dione
IUPAC Name: 1-(4-methoxyphenyl)-3-phenyl-2-phenyliminopropane-1,3-dione
SYSTEMATIC NAME: 1-(4-methoxyphenyl)-3-phenyl-2-phenylimino-propane-1,3-dione
MOLECULAR FORMULA: C22H17NO3
MOLECULAR WEIGHT: 343.37528
SMILES: COC1=CC=C(C=C1)C(=O)C(=NC2=CC=CC=C2)C(=O)C3=CC=CC=C3
Structure:
CAS RN: 92369-83-0
CAS Name: 1-(2-methylpropyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
OPENEYE Name: 1-isobutyldecalin
IUPAC Name: 1-(2-methylpropyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
SYSTEMATIC NAME: 1-(2-methylpropyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
MOLECULAR FORMULA: C14H26
MOLECULAR WEIGHT: 194.35624
SMILES: CC(C)CC1CCCC2C1CCCC2
Structure:
CAS RN: 92369-82-9
CAS Name: 1-butan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
OPENEYE Name: 1-sec-butyldecalin
IUPAC Name: 1-butan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
SYSTEMATIC NAME: 1-butan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
MOLECULAR FORMULA: C14H26
MOLECULAR WEIGHT: 194.35624
SMILES: CCC(C)C1CCCC2C1CCCC2
Structure:
CAS RN: 92369-80-7
CAS Name: 1-butyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
OPENEYE Name: 1-butyldecalin
IUPAC Name: 1-butyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
SYSTEMATIC NAME: 1-butyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
MOLECULAR FORMULA: C14H26
MOLECULAR WEIGHT: 194.35624
SMILES: CCCCC1CCCC2C1CCCC2
Structure:
CAS RN: 92341-29-2
CAS Name: dodecanoic acid [4-[4-[4-(1-oxododecoxy)phenyl]buta-1,3-diynyl]phenyl] ester
OPENEYE Name: [4-[4-(4-dodecanoyloxyphenyl)buta-1,3-diynyl]phenyl] dodecanoate
IUPAC Name: [4-[4-(4-dodecanoyloxyphenyl)buta-1,3-diynyl]phenyl] dodecanoate
SYSTEMATIC NAME: [4-[4-(4-dodecanoyloxyphenyl)buta-1,3-diynyl]phenyl] dodecanoate
MOLECULAR FORMULA: C40H54O4
MOLECULAR WEIGHT: 598.85436
SMILES: CCCCCCCCCCCC(=O)OC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)OC(=O)CCCCCCCCCCC
Structure:
CAS RN: 92341-28-1
CAS Name: decanoic acid [4-[4-[4-(1-oxodecoxy)phenyl]buta-1,3-diynyl]phenyl] ester
OPENEYE Name: [4-[4-(4-decanoyloxyphenyl)buta-1,3-diynyl]phenyl] decanoate
IUPAC Name: [4-[4-(4-decanoyloxyphenyl)buta-1,3-diynyl]phenyl] decanoate
SYSTEMATIC NAME: [4-[4-(4-decanoyloxyphenyl)buta-1,3-diynyl]phenyl] decanoate
MOLECULAR FORMULA: C36H46O4
MOLECULAR WEIGHT: 542.74804
SMILES: CCCCCCCCCC(=O)OC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)OC(=O)CCCCCCCCC
Structure:
CAS RN: 92341-27-0
CAS Name: heptanoic acid [4-[4-[4-(1-oxoheptoxy)phenyl]buta-1,3-diynyl]phenyl] ester
OPENEYE Name: [4-[4-(4-heptanoyloxyphenyl)buta-1,3-diynyl]phenyl] heptanoate
IUPAC Name: [4-[4-(4-heptanoyloxyphenyl)buta-1,3-diynyl]phenyl] heptanoate
SYSTEMATIC NAME: [4-[4-(4-heptanoyloxyphenyl)buta-1,3-diynyl]phenyl] heptanoate
MOLECULAR FORMULA: C30H34O4
MOLECULAR WEIGHT: 458.58856
SMILES: CCCCCCC(=O)OC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)OC(=O)CCCCCC
Structure:
CAS RN: 92341-26-9
CAS Name: hexanoic acid [4-[4-[4-(1-oxohexoxy)phenyl]buta-1,3-diynyl]phenyl] ester
OPENEYE Name: [4-[4-(4-hexanoyloxyphenyl)buta-1,3-diynyl]phenyl] hexanoate
IUPAC Name: [4-[4-(4-hexanoyloxyphenyl)buta-1,3-diynyl]phenyl] hexanoate
SYSTEMATIC NAME: [4-[4-(4-hexanoyloxyphenyl)buta-1,3-diynyl]phenyl] hexanoate
MOLECULAR FORMULA: C28H30O4
MOLECULAR WEIGHT: 430.5354
SMILES: CCCCCC(=O)OC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)OC(=O)CCCCC
Structure:
CAS RN: 92341-25-8
CAS Name: butanoic acid [4-[4-[4-(1-oxobutoxy)phenyl]buta-1,3-diynyl]phenyl] ester
OPENEYE Name: [4-[4-(4-butanoyloxyphenyl)buta-1,3-diynyl]phenyl] butanoate
IUPAC Name: [4-[4-(4-butanoyloxyphenyl)buta-1,3-diynyl]phenyl] butanoate
SYSTEMATIC NAME: [4-[4-(4-butanoyloxyphenyl)buta-1,3-diynyl]phenyl] butanoate
MOLECULAR FORMULA: C24H22O4
MOLECULAR WEIGHT: 374.42908
SMILES: CCCC(=O)OC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)OC(=O)CCC
Structure:
CAS RN: 92341-24-7
CAS Name: propanoic acid [4-[4-[4-(1-oxopropoxy)phenyl]buta-1,3-diynyl]phenyl] ester
OPENEYE Name: [4-[4-(4-propanoyloxyphenyl)buta-1,3-diynyl]phenyl] propanoate
IUPAC Name: [4-[4-(4-propanoyloxyphenyl)buta-1,3-diynyl]phenyl] propanoate
SYSTEMATIC NAME: [4-[4-(4-propanoyloxyphenyl)buta-1,3-diynyl]phenyl] propanoate
MOLECULAR FORMULA: C22H18O4
MOLECULAR WEIGHT: 346.37592
SMILES: CCC(=O)OC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)OC(=O)CC
Structure:
CAS RN: 92341-23-6
CAS Name: acetic acid [4-[4-(4-acetyloxyphenyl)buta-1,3-diynyl]phenyl] ester
OPENEYE Name: [4-[4-(4-acetoxyphenyl)buta-1,3-diynyl]phenyl] acetate
IUPAC Name: [4-[4-(4-acetyloxyphenyl)buta-1,3-diynyl]phenyl] acetate
SYSTEMATIC NAME: [4-[4-(4-acetyloxyphenyl)buta-1,3-diynyl]phenyl] ethanoate
MOLECULAR FORMULA: C20H14O4
MOLECULAR WEIGHT: 318.32276
SMILES: CC(=O)OC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)OC(=O)C
Structure:
CAS RN: 92272-66-7
CAS Name: 5,7,12-trioxa-1-aza-6-borabicyclo[4.3.3]dodecan-4-one
OPENEYE Name: 5,7,12-trioxa-1-aza-6-borabicyclo[4.3.3]dodecan-4-one
IUPAC Name: 5,7,12-trioxa-1-aza-6-borabicyclo[4.3.3]dodecan-4-one
SYSTEMATIC NAME: 5,7,12-trioxa-1-aza-6-borabicyclo[4.3.3]dodecan-4-one
MOLECULAR FORMULA: C7H12BNO4
MOLECULAR WEIGHT: 184.98548
SMILES: B12OCCN(CCC(=O)O1)CCO2
Structure:
CAS RN: 92234-54-3
CAS Name: 1-(1-adamantyl)pyrazole
OPENEYE Name: 1-(1-adamantyl)pyrazole
IUPAC Name: 1-(1-adamantyl)pyrazole
SYSTEMATIC NAME: 1-(1-adamantyl)pyrazole
MOLECULAR FORMULA: C13H18N2
MOLECULAR WEIGHT: 202.29542
SMILES: C1C2CC3CC1CC(C2)(C3)N4C=CC=N4
Structure:
CAS RN: 92224-19-6
CAS Name: 1,3,3a,7,8,8a-hexahydrothieno[3,4-d]thiepin
OPENEYE Name: 1,3,3a,7,8,8a-hexahydrothieno[3,4-d]thiepine
IUPAC Name: 1,3,3a,7,8,8a-hexahydrothieno[3,4-d]thiepine
SYSTEMATIC NAME: 1,3,3a,7,8,8a-hexahydrothieno[3,4-d]thiepine
MOLECULAR FORMULA: C8H12S2
MOLECULAR WEIGHT: 172.31088
SMILES: C1CSC=CC2C1CSC2
Structure:
CAS RN: 92141-86-1
CAS Name: cesium oxido(oxo)borane
OPENEYE Name: cesium oxido(oxo)borane
IUPAC Name: cesium oxido(oxo)borane
SYSTEMATIC NAME: cesium oxidanidyl(oxidanylidene)borane
MOLECULAR FORMULA: BCsO2
MOLECULAR WEIGHT: 175.71525
SMILES: B(=O)[O-].[Cs+]
Structure:
CAS RN: 92013-89-3
CAS Name: N,N-dimethyl-9H-fluoren-4-amine
OPENEYE Name: N,N-dimethyl-9H-fluoren-4-amine
IUPAC Name: N,N-dimethyl-9H-fluoren-4-amine
SYSTEMATIC NAME: N,N-dimethyl-9H-fluoren-4-amine
MOLECULAR FORMULA: C15H15N
MOLECULAR WEIGHT: 209.2863
SMILES: CN(C)C1=CC=CC2=C1C3=CC=CC=C3C2
Structure:
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