CAS RN: 70220-95-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C11H16O
MOLECULAR WEIGHT: 164.24414
SMILES: C1CC2C3CC(C=C3)C(C1)C2O
Structure:
CAS RN: 70187-91-6
CAS Name: acetic acid 2,6-dimethylhepta-1,6-dien-4-yl ester
OPENEYE Name: [3-methyl-1-(2-methylallyl)but-3-enyl] acetate
IUPAC Name: 2,6-dimethylhepta-1,6-dien-4-yl acetate
SYSTEMATIC NAME: 2,6-dimethylhepta-1,6-dien-4-yl ethanoate
MOLECULAR FORMULA: C11H18O2
MOLECULAR WEIGHT: 182.25942
SMILES: CC(=C)CC(CC(=C)C)OC(=O)C
Structure:
CAS RN: 70138-31-7
CAS Name: 3,3,3-trimethoxypropanenitrile
OPENEYE Name: 3,3,3-trimethoxypropanenitrile
IUPAC Name: 3,3,3-trimethoxypropanenitrile
SYSTEMATIC NAME: 3,3,3-trimethoxypropanenitrile
MOLECULAR FORMULA: C6H11NO3
MOLECULAR WEIGHT: 145.15644
SMILES: COC(CC#N)(OC)OC
Structure:
CAS RN: 70134-71-3
CAS Name: 3,4-dibromo-2-oxido-1,2,5-oxadiazol-2-ium
OPENEYE Name: 3,4-dibromo-2-oxido-1,2,5-oxadiazol-2-ium
IUPAC Name: 3,4-dibromo-2-oxido-1,2,5-oxadiazol-2-ium
SYSTEMATIC NAME: 3,4-bis(bromanyl)-2-oxidanidyl-1,2,5-oxadiazol-2-ium
MOLECULAR FORMULA: C2Br2N2O2
MOLECULAR WEIGHT: 243.8416
SMILES: C1(=NO[N+](=C1Br)[O-])Br
Structure:
CAS RN: 70086-67-8
CAS Name: 2-(methylseleno)aniline
OPENEYE Name: 2-methylselanylaniline
IUPAC Name: 2-methylselanylaniline
SYSTEMATIC NAME: 2-methylselanylaniline
MOLECULAR FORMULA: C7H9NSe
MOLECULAR WEIGHT: 186.11306
SMILES: C[Se]C1=CC=CC=C1N
Structure:
CAS RN: 70086-66-7
CAS Name: 3-(methylseleno)aniline
OPENEYE Name: 3-methylselanylaniline
IUPAC Name: 3-methylselanylaniline
SYSTEMATIC NAME: 3-methylselanylaniline
MOLECULAR FORMULA: C7H9NSe
MOLECULAR WEIGHT: 186.11306
SMILES: C[Se]C1=CC=CC(=C1)N
Structure:
CAS RN: 70086-65-6
CAS Name: 1-(methylseleno)-4-(methylthio)benzene
OPENEYE Name: 1-methylselanyl-4-methylsulfanyl-benzene
IUPAC Name: 1-methylselanyl-4-methylsulfanylbenzene
SYSTEMATIC NAME: 1-methylselanyl-4-methylsulfanyl-benzene
MOLECULAR FORMULA: C8H10SSe
MOLECULAR WEIGHT: 217.19
SMILES: CSC1=CC=C(C=C1)[Se]C
Structure:
CAS RN: 70058-04-7
CAS Name: 2-methyl-3-propan-2-ylhex-2-en-4-yne
OPENEYE Name: 3-isopropyl-2-methyl-hex-2-en-4-yne
IUPAC Name: 2-methyl-3-propan-2-ylhex-2-en-4-yne
SYSTEMATIC NAME: 2-methyl-3-propan-2-yl-hex-2-en-4-yne
MOLECULAR FORMULA: C10H16
MOLECULAR WEIGHT: 136.23404
SMILES: CC#CC(=C(C)C)C(C)C
Structure:
CAS RN: 70058-01-4
CAS Name: 5-ethylhept-4-en-2-yne
OPENEYE Name: 5-ethylhept-4-en-2-yne
IUPAC Name: 5-ethylhept-4-en-2-yne
SYSTEMATIC NAME: 5-ethylhept-4-en-2-yne
MOLECULAR FORMULA: C9H14
MOLECULAR WEIGHT: 122.20746
SMILES: CCC(=CC#CC)CC
Structure:
CAS RN: 70058-00-3
CAS Name: 2-methylnon-1-en-3-yne
OPENEYE Name: 2-methylnon-1-en-3-yne
IUPAC Name: 2-methylnon-1-en-3-yne
SYSTEMATIC NAME: 2-methylnon-1-en-3-yne
MOLECULAR FORMULA: C10H16
MOLECULAR WEIGHT: 136.23404
SMILES: CCCCCC#CC(=C)C
Structure:
CAS RN: 69915-28-2
CAS Name: 9-mercapto-1-phenalenone
OPENEYE Name: 9-sulfanylphenalen-1-one
IUPAC Name: 9-sulfanylphenalen-1-one
SYSTEMATIC NAME: 9-sulfanylphenalen-1-one
MOLECULAR FORMULA: C13H8OS
MOLECULAR WEIGHT: 212.26702
SMILES: C1=CC2=C3C(=C1)C=CC(=O)C3=C(C=C2)S
Structure:
CAS RN: 69723-93-9
CAS Name: chloro-$l^{3}-silane
OPENEYE Name: chloro-$l^{3}-silane
IUPAC Name: chloro-$l^{3}-silane
SYSTEMATIC NAME: chloranyl-$l^{3}-silane
MOLECULAR FORMULA: ClH2Si
MOLECULAR WEIGHT: 65.55438
SMILES: [SiH2]Cl
Structure:
CAS RN: 69697-81-0
CAS Name: 1-methoxy-5-methyl-3-methylenecyclohexene
OPENEYE Name: 1-methoxy-5-methyl-3-methylene-cyclohexene
IUPAC Name: 1-methoxy-5-methyl-3-methylidenecyclohexene
SYSTEMATIC NAME: 1-methoxy-5-methyl-3-methylidene-cyclohexene
MOLECULAR FORMULA: C9H14O
MOLECULAR WEIGHT: 138.20686
SMILES: CC1CC(=C)C=C(C1)OC
Structure:
CAS RN: 69657-20-1
CAS Name: 1,1-diethyl-2,5-dihydrosilole
OPENEYE Name: 1,1-diethyl-2,5-dihydrosilole
IUPAC Name: 1,1-diethyl-2,5-dihydrosilole
SYSTEMATIC NAME: 1,1-diethyl-2,5-dihydrosilole
MOLECULAR FORMULA: C8H16Si
MOLECULAR WEIGHT: 140.29814
SMILES: CC[Si]1(CC=CC1)CC
Structure:
CAS RN: 69655-76-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H24O12Si8
MOLECULAR WEIGHT: 633.03856
SMILES: C=C[Si]12O[Si]3(O[Si]4(O[Si](O1)(O[Si]5(O[Si](O2)(O[Si](O3)(O[Si](O4)(O5)C=C)C=C)C=C)C=C)C=C)C=C)C=C
Structure:
CAS RN: 69645-14-3
CAS Name: 2-(4-chlorophenyl)-3-methyl-1-cycloprop-2-enecarboxylic acid methyl ester
OPENEYE Name: methyl 2-(4-chlorophenyl)-3-methyl-cycloprop-2-ene-1-carboxylate
IUPAC Name: methyl 2-(4-chlorophenyl)-3-methylcycloprop-2-ene-1-carboxylate
SYSTEMATIC NAME: methyl 2-(4-chlorophenyl)-3-methyl-cycloprop-2-ene-1-carboxylate
MOLECULAR FORMULA: C12H11ClO2
MOLECULAR WEIGHT: 222.66754
SMILES: CC1=C(C1C(=O)OC)C2=CC=C(C=C2)Cl
Structure:
CAS RN: 69631-55-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H20
MOLECULAR WEIGHT: 260.3728
SMILES: C1CC2=C3CCC4=C1C=CC5=C4CCC3=C(CC5)C=C2
Structure:
CAS RN: 7242-33-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H20
MOLECULAR WEIGHT: 260.3728
SMILES: C1CC2=C3CCC4=C1C=CC5=C4CCC3=C(CC5)C=C2
Structure:
CAS RN: 69626-80-8
CAS Name: 2-isothiocyanatooctane
OPENEYE Name: 2-isothiocyanatooctane
IUPAC Name: 2-isothiocyanatooctane
SYSTEMATIC NAME: 2-isothiocyanatooctane
MOLECULAR FORMULA: C9H17NS
MOLECULAR WEIGHT: 171.30298
SMILES: CCCCCCC(C)N=C=S
Structure:
CAS RN: 69614-95-5
CAS Name: 1-[4-(2-chloroethyl)phenyl]ethanone
OPENEYE Name: 1-[4-(2-chloroethyl)phenyl]ethanone
IUPAC Name: 1-[4-(2-chloroethyl)phenyl]ethanone
SYSTEMATIC NAME: 1-[4-(2-chloroethyl)phenyl]ethanone
MOLECULAR FORMULA: C10H11ClO
MOLECULAR WEIGHT: 182.64674
SMILES: CC(=O)C1=CC=C(C=C1)CCCl
Structure:
CAS RN: 69553-67-9
CAS Name: carbanide; ethyne; thorium(2+)
OPENEYE Name: acetylene; carbanide; thorium(2+)
IUPAC Name: carbanide; ethyne; thorium(2+)
SYSTEMATIC NAME: carbanide; ethyne; thorium(2+)
MOLECULAR FORMULA: C3H4Th
MOLECULAR WEIGHT: 272.10196
SMILES: [CH3-].C#[C-].[Th+2]
Structure:
CAS RN: 69492-24-6
CAS Name: 8,9-dioxabicyclo[5.2.1]decane
OPENEYE Name: 8,9-dioxabicyclo[5.2.1]decane
IUPAC Name: 8,9-dioxabicyclo[5.2.1]decane
SYSTEMATIC NAME: 8,9-dioxabicyclo[5.2.1]decane
MOLECULAR FORMULA: C8H14O2
MOLECULAR WEIGHT: 142.19556
SMILES: C1CCC2CC(CC1)OO2
Structure:
CAS RN: 69461-92-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C11H12O
MOLECULAR WEIGHT: 160.21238
SMILES: C1C2C3CC4C2C5C1C3C(=O)C45
Structure:
CAS RN: 69454-55-3
CAS Name: 9-(dimethylamino)-1-phenalenone
OPENEYE Name: 9-(dimethylamino)phenalen-1-one
IUPAC Name: 9-(dimethylamino)phenalen-1-one
SYSTEMATIC NAME: 9-(dimethylamino)phenalen-1-one
MOLECULAR FORMULA: C15H13NO
MOLECULAR WEIGHT: 223.26982
SMILES: CN(C)C1=C2C(=O)C=CC3=CC=CC(=C32)C=C1
Structure:
CAS RN: 69454-54-2
CAS Name: 9-(methylamino)-1-phenalenone
OPENEYE Name: 9-(methylamino)phenalen-1-one
IUPAC Name: 9-(methylamino)phenalen-1-one
SYSTEMATIC NAME: 9-(methylamino)phenalen-1-one
MOLECULAR FORMULA: C14H11NO
MOLECULAR WEIGHT: 209.24324
SMILES: CNC1=C2C(=O)C=CC3=CC=CC(=C32)C=C1
Structure:
CAS RN: 69454-53-1
CAS Name: 9-butoxy-1-phenalenone
OPENEYE Name: 9-butoxyphenalen-1-one
IUPAC Name: 9-butoxyphenalen-1-one
SYSTEMATIC NAME: 9-butoxyphenalen-1-one
MOLECULAR FORMULA: C17H16O2
MOLECULAR WEIGHT: 252.30774
SMILES: CCCCOC1=C2C(=O)C=CC3=CC=CC(=C32)C=C1
Structure:
CAS RN: 69320-68-9
CAS Name: 1,3,3,5,5-pentamethyl-1,3,5-azadisilinane
OPENEYE Name: 1,3,3,5,5-pentamethyl-1,3,5-azadisilinane
IUPAC Name: 1,3,3,5,5-pentamethyl-1,3,5-azadisilinane
SYSTEMATIC NAME: 1,3,3,5,5-pentamethyl-1,3,5-azadisilinane
MOLECULAR FORMULA: C8H21NSi2
MOLECULAR WEIGHT: 187.43004
SMILES: CN1C[Si](C[Si](C1)(C)C)(C)C
Structure:
CAS RN: 69320-67-8
CAS Name: N-methyl-1-trimethylsilyl-N-(trimethylsilylmethyl)methanamine
OPENEYE Name: N-methyl-1-trimethylsilyl-N-(trimethylsilylmethyl)methanamine
IUPAC Name: N-methyl-1-trimethylsilyl-N-(trimethylsilylmethyl)methanamine
SYSTEMATIC NAME: N-methyl-1-trimethylsilyl-N-(trimethylsilylmethyl)methanamine
MOLECULAR FORMULA: C9H25NSi2
MOLECULAR WEIGHT: 203.4725
SMILES: CN(C[Si](C)(C)C)C[Si](C)(C)C
Structure:
CAS RN: 69298-66-4
CAS Name: (3-methyl-1-diazepinyl)-phenylmethanone
OPENEYE Name: (3-methyldiazepin-1-yl)-phenyl-methanone
IUPAC Name: (3-methyldiazepin-1-yl)-phenylmethanone
SYSTEMATIC NAME: (3-methyl-1,2-diazepin-1-yl)-phenyl-methanone
MOLECULAR FORMULA: C13H12N2O
MOLECULAR WEIGHT: 212.24718
SMILES: CC1=NN(C=CC=C1)C(=O)C2=CC=CC=C2
Structure:
CAS RN: 69287-13-4
CAS Name: 1-(4-methoxyphenyl)-1-heptanone
OPENEYE Name: 1-(4-methoxyphenyl)heptan-1-one
IUPAC Name: 1-(4-methoxyphenyl)heptan-1-one
SYSTEMATIC NAME: 1-(4-methoxyphenyl)heptan-1-one
MOLECULAR FORMULA: C14H20O2
MOLECULAR WEIGHT: 220.3074
SMILES: CCCCCCC(=O)C1=CC=C(C=C1)OC
Structure:
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