CAS RN: 23162-99-4
CAS Name: N,N-difluoro-1-phenylmethanamine
OPENEYE Name: N,N-difluoro-1-phenyl-methanamine
IUPAC Name: N,N-difluoro-1-phenylmethanamine
SYSTEMATIC NAME: N,N-bis(fluoranyl)-1-phenyl-methanamine
MOLECULAR FORMULA: C7H7F2N
MOLECULAR WEIGHT: 143.133986
SMILES: C1=CC=C(C=C1)CN(F)F
Structure:
CAS RN: 23138-55-8
CAS Name: 1-bromo-3-isocyanatobenzene
OPENEYE Name: 1-bromo-3-isocyanato-benzene
IUPAC Name: 1-bromo-3-isocyanatobenzene
SYSTEMATIC NAME: 1-bromanyl-3-isocyanato-benzene
MOLECULAR FORMULA: C7H4BrNO
MOLECULAR WEIGHT: 198.01676
SMILES: C1=CC(=CC(=C1)Br)N=C=O
Structure:
CAS RN: 23132-47-0
CAS Name: 1,2,2-trimethylaziridine
OPENEYE Name: 1,2,2-trimethylaziridine
IUPAC Name: 1,2,2-trimethylaziridine
SYSTEMATIC NAME: 1,2,2-trimethylaziridine
MOLECULAR FORMULA: C5H11N
MOLECULAR WEIGHT: 85.14754
SMILES: CC1(CN1C)C
Structure:
CAS RN: 23101-87-3
CAS Name: 2-(1,3-dioxo-2-isoindolyl)propanal
OPENEYE Name: 2-(1,3-dioxoisoindolin-2-yl)propanal
IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)propanal
SYSTEMATIC NAME: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanal
MOLECULAR FORMULA: C11H9NO3
MOLECULAR WEIGHT: 203.19406
SMILES: CC(C=O)N1C(=O)C2=CC=CC=C2C1=O
Structure:
CAS RN: 23072-51-7
CAS Name: 1-fluoro-1,1,2,2,2-pentanitroethane
OPENEYE Name: 1-fluoro-1,1,2,2,2-pentanitro-ethane
IUPAC Name: 1-fluoro-1,1,2,2,2-pentanitroethane
SYSTEMATIC NAME: 1-fluoranyl-1,1,2,2,2-pentanitro-ethane
MOLECULAR FORMULA: C2FN5O10
MOLECULAR WEIGHT: 273.047303
SMILES: C(C([N+](=O)[O-])([N+](=O)[O-])F)([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 23069-99-0
CAS Name: N-(2-phenylethyl)formamide
OPENEYE Name: N-(2-phenylethyl)formamide
IUPAC Name: N-(2-phenylethyl)formamide
SYSTEMATIC NAME: N-(2-phenylethyl)methanamide
MOLECULAR FORMULA: C9H11NO
MOLECULAR WEIGHT: 149.18974
SMILES: C1=CC=C(C=C1)CCNC=O
Structure:
CAS RN: 23063-31-2
CAS Name: (2,3-dimethyl-1-cycloprop-2-enyl)benzene
OPENEYE Name: (2,3-dimethylcycloprop-2-en-1-yl)benzene
IUPAC Name: (2,3-dimethylcycloprop-2-en-1-yl)benzene
SYSTEMATIC NAME: (2,3-dimethylcycloprop-2-en-1-yl)benzene
MOLECULAR FORMULA: C11H12
MOLECULAR WEIGHT: 144.21298
SMILES: CC1=C(C1C2=CC=CC=C2)C
Structure:
CAS RN: 23062-34-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H8OS2
MOLECULAR WEIGHT: 208.29992
SMILES: C1C2=CSC=C2C3=CSC=C3CO1
Structure:
CAS RN: 5205-06-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H8OS2
MOLECULAR WEIGHT: 208.29992
SMILES: C1C2=CSC=C2C3=CSC=C3CO1
Structure:
CAS RN: 23057-36-5
CAS Name: bicyclo[4.2.1]non-5-ene
OPENEYE Name: bicyclo[4.2.1]non-5-ene
IUPAC Name: bicyclo[4.2.1]non-5-ene
SYSTEMATIC NAME: bicyclo[4.2.1]non-5-ene
MOLECULAR FORMULA: C9H14
MOLECULAR WEIGHT: 122.20746
SMILES: C1CC=C2CCC(C1)C2
Structure:
CAS RN: 23057-35-4
CAS Name: bicyclo[4.2.1]non-6-ene
OPENEYE Name: bicyclo[4.2.1]non-6-ene
IUPAC Name: bicyclo[4.2.1]non-6-ene
SYSTEMATIC NAME: bicyclo[4.2.1]non-6-ene
MOLECULAR FORMULA: C9H14
MOLECULAR WEIGHT: 122.20746
SMILES: C1CCC2=CCC(C1)C2
Structure:
CAS RN: 23056-94-2
CAS Name: 2-methylhex-1-en-3-yne
OPENEYE Name: 2-methylhex-1-en-3-yne
IUPAC Name: 2-methylhex-1-en-3-yne
SYSTEMATIC NAME: 2-methylhex-1-en-3-yne
MOLECULAR FORMULA: C7H10
MOLECULAR WEIGHT: 94.1543
SMILES: CCC#CC(=C)C
Structure:
CAS RN: 23044-57-7
CAS Name: N,1-ditert-butyl-2-methyl-3-diaziridinimine
OPENEYE Name: N,1-ditert-butyl-2-methyl-diaziridin-3-imine
IUPAC Name: N,1-ditert-butyl-2-methyldiaziridin-3-imine
SYSTEMATIC NAME: N,1-ditert-butyl-2-methyl-1,2-diaziridin-3-imine
MOLECULAR FORMULA: C10H21N3
MOLECULAR WEIGHT: 183.29384
SMILES: CC(C)(C)N=C1N(N1C(C)(C)C)C
Structure:
CAS RN: 23039-94-3
CAS Name: tris(3-fluorophenyl)phosphine
OPENEYE Name: tris(3-fluorophenyl)phosphane
IUPAC Name: tris(3-fluorophenyl)phosphane
SYSTEMATIC NAME: tris(3-fluorophenyl)phosphane
MOLECULAR FORMULA: C18H12F3P
MOLECULAR WEIGHT: 316.256851
SMILES: C1=CC(=CC(=C1)P(C2=CC=CC(=C2)F)C3=CC=CC(=C3)F)F
Structure:
CAS RN: 23026-73-5
CAS Name: 5,7-dimethyl-6-cyclohepta[c]thiophenone
OPENEYE Name: 5,7-dimethylcyclohepta[c]thiophen-6-one
IUPAC Name: 5,7-dimethylcyclohepta[c]thiophen-6-one
SYSTEMATIC NAME: 5,7-dimethylcyclohepta[c]thiophen-6-one
MOLECULAR FORMULA: C11H10OS
MOLECULAR WEIGHT: 190.2615
SMILES: CC1=CC2=CSC=C2C=C(C1=O)C
Structure:
CAS RN: 23022-40-4
CAS Name: 1H-inden-1-yl(trimethyl)stannane
OPENEYE Name: 1H-inden-1-yl(trimethyl)stannane
IUPAC Name: 1H-inden-1-yl(trimethyl)stannane
SYSTEMATIC NAME: 1H-inden-1-yl(trimethyl)stannane
MOLECULAR FORMULA: C12H16Sn
MOLECULAR WEIGHT: 278.96544
SMILES: C[Sn](C)(C)C1C=CC2=CC=CC=C12
Structure:
CAS RN: 23014-57-5
CAS Name: 1,1,4,4,10,10,13,13-octamethylcyclooctadecane
OPENEYE Name: 1,1,4,4,10,10,13,13-octamethylcyclooctadecane
IUPAC Name: 1,1,4,4,10,10,13,13-octamethylcyclooctadecane
SYSTEMATIC NAME: 1,1,4,4,10,10,13,13-octamethylcyclooctadecane
MOLECULAR FORMULA: C26H52
MOLECULAR WEIGHT: 364.69108
SMILES: CC1(CCCCCC(CCC(CCCCCC(CC1)(C)C)(C)C)(C)C)C
Structure:
CAS RN: 23014-56-4
CAS Name: 1,1,10,10-tetramethylcyclooctadecane
OPENEYE Name: 1,1,10,10-tetramethylcyclooctadecane
IUPAC Name: 1,1,10,10-tetramethylcyclooctadecane
SYSTEMATIC NAME: 1,1,10,10-tetramethylcyclooctadecane
MOLECULAR FORMULA: C22H44
MOLECULAR WEIGHT: 308.58476
SMILES: CC1(CCCCCCCCC(CCCCCCCC1)(C)C)C
Structure:
CAS RN: 23010-04-0
CAS Name: 1,2-dichloro-2-methylbutane
OPENEYE Name: 1,2-dichloro-2-methyl-butane
IUPAC Name: 1,2-dichloro-2-methylbutane
SYSTEMATIC NAME: 1,2-bis(chloranyl)-2-methyl-butane
MOLECULAR FORMULA: C5H10Cl2
MOLECULAR WEIGHT: 141.0389
SMILES: CCC(C)(CCl)Cl
Structure:
CAS RN: 23003-45-4
CAS Name: 2,3-dihydrothiazolo[3,2-a]pyridin-4-ium-8-olate
OPENEYE Name: 2,3-dihydrothiazolo[3,2-a]pyridin-4-ium-8-olate
IUPAC Name: 2,3-dihydro-[1,3]thiazolo[3,2-a]pyridin-4-ium-8-olate
SYSTEMATIC NAME: 2,3-dihydro-[1,3]thiazolo[3,2-a]pyridin-4-ium-8-olate
MOLECULAR FORMULA: C7H7NOS
MOLECULAR WEIGHT: 153.20158
SMILES: C1CSC2=C(C=CC=[N+]21)[O-]
Structure:
CAS RN: 23003-43-2
CAS Name: 5-methyl-2,3-dihydrothiazolo[3,2-a]pyridin-4-ium-8-olate
OPENEYE Name: 5-methyl-2,3-dihydrothiazolo[3,2-a]pyridin-4-ium-8-olate
IUPAC Name: 5-methyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyridin-4-ium-8-olate
SYSTEMATIC NAME: 5-methyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyridin-4-ium-8-olate
MOLECULAR FORMULA: C8H9NOS
MOLECULAR WEIGHT: 167.22816
SMILES: CC1=[N+]2CCSC2=C(C=C1)[O-]
Structure:
CAS RN: 23003-25-0
CAS Name: 6-methyl-2-(methylthio)-3-pyridinol
OPENEYE Name: 6-methyl-2-methylsulfanyl-pyridin-3-ol
IUPAC Name: 6-methyl-2-methylsulfanylpyridin-3-ol
SYSTEMATIC NAME: 6-methyl-2-methylsulfanyl-pyridin-3-ol
MOLECULAR FORMULA: C7H9NOS
MOLECULAR WEIGHT: 155.21746
SMILES: CC1=NC(=C(C=C1)O)SC
Structure:
CAS RN: 22987-45-7
CAS Name: selenohypobromous acid bromo ester
OPENEYE Name: bromo selenohypobromite
IUPAC Name: bromo selenohypobromite
SYSTEMATIC NAME: bromanyl selenohypobromite
MOLECULAR FORMULA: Br2Se
MOLECULAR WEIGHT: 238.768
SMILES: [Se](Br)Br
Structure:
CAS RN: 22980-23-0
CAS Name: 3-oxabicyclo[2.2.0]hex-5-en-2-one
OPENEYE Name: 3-oxabicyclo[2.2.0]hex-5-en-2-one
IUPAC Name: 3-oxabicyclo[2.2.0]hex-5-en-2-one
SYSTEMATIC NAME: 3-oxabicyclo[2.2.0]hex-5-en-2-one
MOLECULAR FORMULA: C5H4O2
MOLECULAR WEIGHT: 96.08406
SMILES: C1=CC2C1C(=O)O2
Structure:
CAS RN: 22968-45-2
CAS Name: 2-selenophenecarboxylic acid
OPENEYE Name: selenophene-2-carboxylic acid
IUPAC Name: selenophene-2-carboxylic acid
SYSTEMATIC NAME: selenophene-2-carboxylic acid
MOLECULAR FORMULA: C5H4O2Se
MOLECULAR WEIGHT: 175.04406
SMILES: C1=C[Se]C(=C1)C(=O)O
Structure:
CAS RN: 22921-72-8
CAS Name: 5-bromopentoxybenzene
OPENEYE Name: 5-bromopentoxybenzene
IUPAC Name: 5-bromopentoxybenzene
SYSTEMATIC NAME: 5-bromanylpentoxybenzene
MOLECULAR FORMULA: C11H15BrO
MOLECULAR WEIGHT: 243.1402
SMILES: C1=CC=C(C=C1)OCCCCCBr
Structure:
CAS RN: 22907-72-8
CAS Name: 1,4-di(propan-2-yl)cyclohexane
OPENEYE Name: 1,4-diisopropylcyclohexane
IUPAC Name: 1,4-di(propan-2-yl)cyclohexane
SYSTEMATIC NAME: 1,4-di(propan-2-yl)cyclohexane
MOLECULAR FORMULA: C12H24
MOLECULAR WEIGHT: 168.31896
SMILES: CC(C)C1CCC(CC1)C(C)C
Structure:
CAS RN: 22900-44-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C28H32O4
MOLECULAR WEIGHT: 432.55128
SMILES: CC1(C2=CC=C(O2)C(C3=CC=C(O3)C(C4=CC=C(O4)C(C5=CC=C1O5)(C)C)(C)C)(C)C)C
Structure:
CAS RN: 22882-43-5
CAS Name: 2-nitro-1-cyclopropanecarboxylic acid
OPENEYE Name: 2-nitrocyclopropanecarboxylic acid
IUPAC Name: 2-nitrocyclopropane-1-carboxylic acid
SYSTEMATIC NAME: 2-nitrocyclopropane-1-carboxylic acid
MOLECULAR FORMULA: C4H5NO4
MOLECULAR WEIGHT: 131.0868
SMILES: C1C(C1[N+](=O)[O-])C(=O)O
Structure:
CAS RN: 22874-80-2
CAS Name: 4-pentenoic acid butyl ester
OPENEYE Name: butyl pent-4-enoate
IUPAC Name: butyl pent-4-enoate
SYSTEMATIC NAME: butyl pent-4-enoate
MOLECULAR FORMULA: C9H16O2
MOLECULAR WEIGHT: 156.22214
SMILES: CCCCOC(=O)CCC=C
Structure:
CAS RN: 22852-11-5
CAS Name: dichlorothulium
OPENEYE Name: dichlorothulium
IUPAC Name: dichlorothulium
SYSTEMATIC NAME: bis(chloranyl)thulium
MOLECULAR FORMULA: Cl2Tm
MOLECULAR WEIGHT: 239.84021
SMILES: Cl[Tm]Cl
Structure:
CAS RN: 22842-41-7
CAS Name: 2,2,6,6-tetramethyl-4-thianone
OPENEYE Name: 2,2,6,6-tetramethyltetrahydrothiopyran-4-one
IUPAC Name: 2,2,6,6-tetramethylthian-4-one
SYSTEMATIC NAME: 2,2,6,6-tetramethylthian-4-one
MOLECULAR FORMULA: C9H16OS
MOLECULAR WEIGHT: 172.28774
SMILES: CC1(CC(=O)CC(S1)(C)C)C
Structure:
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