CAS RN: 4988-33-4
CAS Name: thiane 1,1-dioxide
OPENEYE Name: thiane 1,1-dioxide
IUPAC Name: thiane 1,1-dioxide
SYSTEMATIC NAME: thiane 1,1-dioxide
MOLECULAR FORMULA: C5H10O2S
MOLECULAR WEIGHT: 134.1967
SMILES: C1CCS(=O)(=O)CC1
Structure:
CAS RN: 4985-62-0
CAS Name: $l^{1}-sulfanylbenzene
OPENEYE Name: $l^{1}-sulfanylbenzene
IUPAC Name: $l^{1}-sulfanylbenzene
SYSTEMATIC NAME: $l^{1}-sulfanylbenzene
MOLECULAR FORMULA: C6H5S
MOLECULAR WEIGHT: 109.1689
SMILES: C1=CC=C(C=C1)[S]
Structure:
CAS RN: 4985-58-4
CAS Name: 1-$l^{1}-sulfanylpropane
OPENEYE Name: 1-$l^{1}-sulfanylpropane
IUPAC Name: 1-$l^{1}-sulfanylpropane
SYSTEMATIC NAME: 1-$l^{1}-sulfanylpropane
MOLECULAR FORMULA: C3H7S
MOLECULAR WEIGHT: 75.15268
SMILES: CCC[S]
Structure:
CAS RN: 4975-21-7
CAS Name: 3,4-dimethyl-1,2,5-oxadiazole
OPENEYE Name: 3,4-dimethyl-1,2,5-oxadiazole
IUPAC Name: 3,4-dimethyl-1,2,5-oxadiazole
SYSTEMATIC NAME: 3,4-dimethyl-1,2,5-oxadiazole
MOLECULAR FORMULA: C4H6N2O
MOLECULAR WEIGHT: 98.10324
SMILES: CC1=NON=C1C
Structure:
CAS RN: 4965-33-7
CAS Name: 7-chloro-2-methylquinoline
OPENEYE Name: 7-chloro-2-methyl-quinoline
IUPAC Name: 7-chloro-2-methylquinoline
SYSTEMATIC NAME: 7-chloranyl-2-methyl-quinoline
MOLECULAR FORMULA: C10H8ClN
MOLECULAR WEIGHT: 177.63022
SMILES: CC1=NC2=C(C=C1)C=CC(=C2)Cl
Structure:
CAS RN: 4960-86-5
CAS Name: chloro(deuterio)methane
OPENEYE Name: chloro(deuterio)methane
IUPAC Name: chloro(deuterio)methane
SYSTEMATIC NAME: chloranyl(deuterio)methane
MOLECULAR FORMULA: CH3Cl
MOLECULAR WEIGHT: 51.493682
SMILES: [2H]CCl
Structure:
CAS RN: 4952-03-8
CAS Name: 1-hydroperoxy-1-methylcyclohexane
OPENEYE Name: 1-hydroperoxy-1-methyl-cyclohexane
IUPAC Name: 1-hydroperoxy-1-methylcyclohexane
SYSTEMATIC NAME: 1-(dioxidanyl)-1-methyl-cyclohexane
MOLECULAR FORMULA: C7H14O2
MOLECULAR WEIGHT: 130.18486
SMILES: CC1(CCCCC1)OO
Structure:
CAS RN: 4935-01-7
CAS Name: 3-bicyclo[1.1.0]butanecarboxylic acid methyl ester
OPENEYE Name: methyl bicyclo[1.1.0]butane-3-carboxylate
IUPAC Name: methyl bicyclo[1.1.0]butane-3-carboxylate
SYSTEMATIC NAME: methyl bicyclo[1.1.0]butane-3-carboxylate
MOLECULAR FORMULA: C6H8O2
MOLECULAR WEIGHT: 112.12652
SMILES: COC(=O)C12CC1C2
Structure:
CAS RN: 15564-44-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C9H10
MOLECULAR WEIGHT: 118.1757
SMILES: C1C2C=CC1C3C2C=C3
Structure:
CAS RN: 15564-45-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C9H10
MOLECULAR WEIGHT: 118.1757
SMILES: C1C2C=CC1C3C2C=C3
Structure:
CAS RN: 4932-71-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C9H10
MOLECULAR WEIGHT: 118.1757
SMILES: C1C2C=CC1C3C2C=C3
Structure:
CAS RN: 4927-03-1
CAS Name: bicyclo[3.2.0]hept-6-ene
OPENEYE Name: bicyclo[3.2.0]hept-6-ene
IUPAC Name: bicyclo[3.2.0]hept-6-ene
SYSTEMATIC NAME: bicyclo[3.2.0]hept-6-ene
MOLECULAR FORMULA: C7H10
MOLECULAR WEIGHT: 94.1543
SMILES: C1CC2C=CC2C1
Structure:
CAS RN: 4923-79-9
CAS Name: 1-methylazetidine
OPENEYE Name: 1-methylazetidine
IUPAC Name: 1-methylazetidine
SYSTEMATIC NAME: 1-methylazetidine
MOLECULAR FORMULA: C4H9N
MOLECULAR WEIGHT: 71.12096
SMILES: CN1CCC1
Structure:
CAS RN: 23147-72-0
CAS Name: (1-bromo-2,3-diphenyl-1-cycloprop-2-enyl)benzene
OPENEYE Name: (1-bromo-2,3-diphenyl-cycloprop-2-en-1-yl)benzene
IUPAC Name: (1-bromo-2,3-diphenylcycloprop-2-en-1-yl)benzene
SYSTEMATIC NAME: (1-bromanyl-2,3-diphenyl-cycloprop-2-en-1-yl)benzene
MOLECULAR FORMULA: C21H15Br
MOLECULAR WEIGHT: 347.2478
SMILES: C1=CC=C(C=C1)C2=C(C2(C3=CC=CC=C3)Br)C4=CC=CC=C4
Structure:
CAS RN: 4919-37-3
CAS Name: 4-hydroxy-3,5-dimethylbenzoic acid
OPENEYE Name: 4-hydroxy-3,5-dimethyl-benzoic acid
IUPAC Name: 4-hydroxy-3,5-dimethylbenzoic acid
SYSTEMATIC NAME: 3,5-dimethyl-4-oxidanyl-benzoic acid
MOLECULAR FORMULA: C9H10O3
MOLECULAR WEIGHT: 166.1739
SMILES: CC1=CC(=CC(=C1O)C)C(=O)O
Structure:
CAS RN: 4911-60-8
CAS Name: 2,2-dimethyl-3-hexyne
OPENEYE Name: 2,2-dimethylhex-3-yne
IUPAC Name: 2,2-dimethylhex-3-yne
SYSTEMATIC NAME: 2,2-dimethylhex-3-yne
MOLECULAR FORMULA: C8H14
MOLECULAR WEIGHT: 110.19676
SMILES: CCC#CC(C)(C)C
Structure:
CAS RN: 4911-55-1
CAS Name: penta-1,3-diyne
OPENEYE Name: penta-1,3-diyne
IUPAC Name: penta-1,3-diyne
SYSTEMATIC NAME: penta-1,3-diyne
MOLECULAR FORMULA: C5H4
MOLECULAR WEIGHT: 64.08526
SMILES: CC#CC#C
Structure:
CAS RN: 4900-73-6
CAS Name: 6-methyl-7-benzo[7]annulenone
OPENEYE Name: 6-methylbenzo[7]annulen-7-one
IUPAC Name: 6-methylbenzo[7]annulen-7-one
SYSTEMATIC NAME: 6-methylbenzo[7]annulen-7-one
MOLECULAR FORMULA: C12H10O
MOLECULAR WEIGHT: 170.2072
SMILES: CC1=CC2=CC=CC=C2C=CC1=O
Structure:
CAS RN: 4897-73-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H12
MOLECULAR WEIGHT: 156.22368
SMILES: CC1=CC2=C(C=C1)C3CC2C=C3
Structure:
CAS RN: 4897-71-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H12O
MOLECULAR WEIGHT: 172.22308
SMILES: COC1=CC2=C(C=C1)C3CC2C=C3
Structure:
CAS RN: 4894-62-6
CAS Name: 3-methylhepta-1,5-diene
OPENEYE Name: 3-methylhepta-1,5-diene
IUPAC Name: 3-methylhepta-1,5-diene
SYSTEMATIC NAME: 3-methylhepta-1,5-diene
MOLECULAR FORMULA: C8H14
MOLECULAR WEIGHT: 110.19676
SMILES: CC=CCC(C)C=C
Structure:
CAS RN: 4893-13-4
CAS Name: 3-methylbicyclo[2.2.2]oct-2-ene
OPENEYE Name: 3-methylbicyclo[2.2.2]oct-2-ene
IUPAC Name: 3-methylbicyclo[2.2.2]oct-2-ene
SYSTEMATIC NAME: 3-methylbicyclo[2.2.2]oct-2-ene
MOLECULAR FORMULA: C9H14
MOLECULAR WEIGHT: 122.20746
SMILES: CC1=CC2CCC1CC2
Structure:
CAS RN: 4893-00-9
CAS Name: dispiro[3.1.3^{6}.1^{4}]decane-5,10-dione
OPENEYE Name: dispiro[3.1.3^{6}.1^{4}]decane-5,10-dione
IUPAC Name: dispiro[3.1.3^{6}.1^{4}]decane-5,10-dione
SYSTEMATIC NAME: dispiro[3.1.3^{6}.1^{4}]decane-5,10-dione
MOLECULAR FORMULA: C10H12O2
MOLECULAR WEIGHT: 164.20108
SMILES: C1CC2(C1)C(=O)C3(C2=O)CCC3
Structure:
CAS RN: 4891-38-7
CAS Name: 3-phenyl-2-propynoic acid methyl ester
OPENEYE Name: methyl 3-phenylprop-2-ynoate
IUPAC Name: methyl 3-phenylprop-2-ynoate
SYSTEMATIC NAME: methyl 3-phenylprop-2-ynoate
MOLECULAR FORMULA: C10H8O2
MOLECULAR WEIGHT: 160.16932
SMILES: COC(=O)C#CC1=CC=CC=C1
Structure:
CAS RN: 4885-47-6
CAS Name: 1-[ethyl-(ethylthio)phosphoryl]ethane
OPENEYE Name: 1-[ethyl(ethylsulfanyl)phosphoryl]ethane
IUPAC Name: 1-[ethyl(ethylsulfanyl)phosphoryl]ethane
SYSTEMATIC NAME: 1-[ethyl(ethylsulfanyl)phosphoryl]ethane
MOLECULAR FORMULA: C6H15OPS
MOLECULAR WEIGHT: 166.221461
SMILES: CCP(=O)(CC)SCC
Structure:
CAS RN: 4884-21-3
CAS Name: 1-cyclopentylcyclopentene
OPENEYE Name: 1-cyclopentylcyclopentene
IUPAC Name: 1-cyclopentylcyclopentene
SYSTEMATIC NAME: 1-cyclopentylcyclopentene
MOLECULAR FORMULA: C10H16
MOLECULAR WEIGHT: 136.23404
SMILES: C1CCC(C1)C2=CCCC2
Structure:
CAS RN: 4883-96-9
CAS Name: 2-methyl-1-cycloprop-2-enone
OPENEYE Name: 2-methylcycloprop-2-en-1-one
IUPAC Name: 2-methylcycloprop-2-en-1-one
SYSTEMATIC NAME: 2-methylcycloprop-2-en-1-one
MOLECULAR FORMULA: C4H4O
MOLECULAR WEIGHT: 68.07396
SMILES: CC1=CC1=O
Structure:
CAS RN: 4877-39-8
CAS Name: 3-methylenebicyclo[3.2.1]octane
OPENEYE Name: 3-methylenebicyclo[3.2.1]octane
IUPAC Name: 3-methylidenebicyclo[3.2.1]octane
SYSTEMATIC NAME: 3-methylidenebicyclo[3.2.1]octane
MOLECULAR FORMULA: C9H14
MOLECULAR WEIGHT: 122.20746
SMILES: C=C1CC2CCC(C2)C1
Structure:
CAS RN: 4853-74-1
CAS Name: 2-methylsulfonylpropane
OPENEYE Name: 2-methylsulfonylpropane
IUPAC Name: 2-methylsulfonylpropane
SYSTEMATIC NAME: 2-methylsulfonylpropane
MOLECULAR FORMULA: C4H10O2S
MOLECULAR WEIGHT: 122.186
SMILES: CC(C)S(=O)(=O)C
Structure:
CAS RN: 4842-11-9
CAS Name: 2-iodobenzene-1,4-dicarboxylic acid O1-(2-ethoxyethyl) ester O4-methyl ester
OPENEYE Name: O1-(2-ethoxyethyl) O4-methyl 2-iodobenzene-1,4-dicarboxylate
IUPAC Name: 1-O-(2-ethoxyethyl) 4-O-methyl 2-iodobenzene-1,4-dicarboxylate
SYSTEMATIC NAME: O1-(2-ethoxyethyl) O4-methyl 2-iodanylbenzene-1,4-dicarboxylate
MOLECULAR FORMULA: C13H15IO5
MOLECULAR WEIGHT: 378.15967
SMILES: CCOCCOC(=O)C1=C(C=C(C=C1)C(=O)OC)I
Structure:
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