CAS RN: 56707-82-5
CAS Name: N-[7-chloro-3-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-imidazo[4,5-b]pyridinyl]acetamide
OPENEYE Name: N-[7-chloro-3-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]imidazo[4,5-b]pyridin-5-yl]acetamide
IUPAC Name: N-[7-chloro-3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazo[4,5-b]pyridin-5-yl]acetamide
SYSTEMATIC NAME: N-[7-chloranyl-3-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]imidazo[4,5-b]pyridin-5-yl]ethanamide
MOLECULAR FORMULA: C13H15ClN4O5
MOLECULAR WEIGHT: 342.735
SMILES: CC(=O)NC1=NC2=C(C(=C1)Cl)N=CN2C3C(C(C(O3)CO)O)O
Structure:
CAS RN: 68375-42-8
CAS Name: 7-chloro-5-(ethoxycarbonylamino)-3-triazolo[4,5-b]pyridinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate
IUPAC Name: ethyl 7-chloro-5-(ethoxycarbonylamino)triazolo[4,5-b]pyridine-3-carboxylate
SYSTEMATIC NAME: ethyl 7-chloranyl-5-(ethoxycarbonylamino)-[1,2,3]triazolo[4,5-b]pyridine-3-carboxylate
MOLECULAR FORMULA: C11H12ClN5O4
MOLECULAR WEIGHT: 313.69708
SMILES: CCOC(=O)NC1=NC2=C(C(=C1)Cl)N=NN2C(=O)OCC
Structure:
CAS RN: 57680-47-4
CAS Name: 2-(4-amino-1-triazolo[4,5-c]pyridinyl)-5-(hydroxymethyl)oxolane-3,4-diol
OPENEYE Name: 2-(4-aminotriazolo[4,5-c]pyridin-1-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
IUPAC Name: 2-(4-aminotriazolo[4,5-c]pyridin-1-yl)-5-(hydroxymethyl)oxolane-3,4-diol
SYSTEMATIC NAME: 2-(4-azanyl-[1,2,3]triazolo[4,5-c]pyridin-1-yl)-5-(hydroxymethyl)oxolane-3,4-diol
MOLECULAR FORMULA: C10H13N5O4
MOLECULAR WEIGHT: 267.24132
SMILES: C1=CN=C(C2=C1N(N=N2)C3C(C(C(O3)CO)O)O)N
Structure:
CAS RN: 38340-27-1
CAS Name: 2-(4-amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile
OPENEYE Name: 2-(4-amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile
IUPAC Name: 2-(4-amino-2H-pyrazolo[3,4-d]pyrimidin-3-yl)acetonitrile
SYSTEMATIC NAME: 2-(4-azanyl-2H-pyrazolo[3,4-d]pyrimidin-3-yl)ethanenitrile
MOLECULAR FORMULA: C7H6N6
MOLECULAR WEIGHT: 174.16274
SMILES: C1=NC2=NNC(=C2C(=N1)N)CC#N
Structure:
CAS RN: 469-77-2
CAS Name: 2-(1-carboxyundecyl)-5-oxo-2-oxolanecarboxylic acid
OPENEYE Name: 2-(1-carboxyundecyl)-5-oxo-tetrahydrofuran-2-carboxylic acid
IUPAC Name: 2-(1-carboxyundecyl)-5-oxooxolane-2-carboxylic acid
SYSTEMATIC NAME: 5-oxidanylidene-2-(1-oxidanyl-1-oxidanylidene-dodecan-2-yl)oxolane-2-carboxylic acid
MOLECULAR FORMULA: C17H28O6
MOLECULAR WEIGHT: 328.40062
SMILES: CCCCCCCCCCC(C(=O)O)C1(CCC(=O)O1)C(=O)O
Structure:
CAS RN: 54158-67-7
CAS Name: 1',1'-difluoro-4'a-methylspiro[1,3-dioxolane-2,7'-2,3,4,5,6,8-hexahydro-1aH-cyclopropa[j]naphthalene]
OPENEYE Name: 1',1'-difluoro-4'a-methyl-spiro[1,3-dioxolane-2,7'-2,3,4,5,6,8-hexahydro-1aH-cyclopropa[j]naphthalene]
IUPAC Name: 1',1'-difluoro-4'a-methylspiro[1,3-dioxolane-2,7'-2,3,4,5,6,8-hexahydro-1aH-cyclopropa[j]naphthalene]
SYSTEMATIC NAME: 1',1'-bis(fluoranyl)-4'a-methyl-spiro[1,3-dioxolane-2,7'-2,3,4,5,6,8-hexahydro-1aH-cyclopropa[j]naphthalene]
MOLECULAR FORMULA: C14H20F2O2
MOLECULAR WEIGHT: 258.304206
SMILES: CC12CCCC3C1(C3(F)F)CC4(CC2)OCCO4
Structure:
CAS RN: 47461-80-3
CAS Name: N-methyl-N-(phenylmethyl)-1-hexadecanamine
OPENEYE Name: N-benzyl-N-methyl-hexadecan-1-amine
IUPAC Name: N-benzyl-N-methylhexadecan-1-amine
SYSTEMATIC NAME: N-methyl-N-(phenylmethyl)hexadecan-1-amine
MOLECULAR FORMULA: C24H43N
MOLECULAR WEIGHT: 345.60492
SMILES: CCCCCCCCCCCCCCCCN(C)CC1=CC=CC=C1
Structure:
CAS RN: 50640-96-5
CAS Name: 1-(4-methoxyphenyl)-N,N-dimethylethanamine
OPENEYE Name: 1-(4-methoxyphenyl)-N,N-dimethyl-ethanamine
IUPAC Name: 1-(4-methoxyphenyl)-N,N-dimethylethanamine
SYSTEMATIC NAME: 1-(4-methoxyphenyl)-N,N-dimethyl-ethanamine
MOLECULAR FORMULA: C11H17NO
MOLECULAR WEIGHT: 179.25878
SMILES: CC(C1=CC=C(C=C1)OC)N(C)C
Structure:
CAS RN: 17815-88-2
CAS Name: [bromo(fluoro)methyl]benzene
OPENEYE Name: [bromo(fluoro)methyl]benzene
IUPAC Name: [bromo(fluoro)methyl]benzene
SYSTEMATIC NAME: [bromanyl(fluoranyl)methyl]benzene
MOLECULAR FORMULA: C7H6BrF
MOLECULAR WEIGHT: 189.024943
SMILES: C1=CC=C(C=C1)C(F)Br
Structure:
CAS RN: 54531-77-0
CAS Name: benzoic acid 1,4-dithiaspiro[4.5]decan-8-yl ester
OPENEYE Name: 1,4-dithiaspiro[4.5]decan-8-yl benzoate
IUPAC Name: 1,4-dithiaspiro[4.5]decan-8-yl benzoate
SYSTEMATIC NAME: 1,4-dithiaspiro[4.5]decan-8-yl benzoate
MOLECULAR FORMULA: C15H18O2S2
MOLECULAR WEIGHT: 294.43222
SMILES: C1CC2(CCC1OC(=O)C3=CC=CC=C3)SCCS2
Structure:
CAS RN: 54531-73-6
CAS Name: 2-(1,4-dithiaspiro[4.5]decan-8-ylidene)acetic acid ethyl ester
OPENEYE Name: ethyl 2-(1,4-dithiaspiro[4.5]decan-8-ylidene)acetate
IUPAC Name: ethyl 2-(1,4-dithiaspiro[4.5]decan-8-ylidene)acetate
SYSTEMATIC NAME: ethyl 2-(1,4-dithiaspiro[4.5]decan-8-ylidene)ethanoate
MOLECULAR FORMULA: C12H18O2S2
MOLECULAR WEIGHT: 258.40012
SMILES: CCOC(=O)C=C1CCC2(CC1)SCCS2
Structure:
CAS RN: 22428-86-0
CAS Name: 1,4-dithiaspiro[4.5]decan-8-ol
OPENEYE Name: 1,4-dithiaspiro[4.5]decan-8-ol
IUPAC Name: 1,4-dithiaspiro[4.5]decan-8-ol
SYSTEMATIC NAME: 1,4-dithiaspiro[4.5]decan-8-ol
MOLECULAR FORMULA: C8H14OS2
MOLECULAR WEIGHT: 190.32616
SMILES: C1CC2(CCC1O)SCCS2
Structure:
CAS RN: 87453-27-8
CAS Name: fluoromethoxybenzene
OPENEYE Name: fluoromethoxybenzene
IUPAC Name: fluoromethoxybenzene
SYSTEMATIC NAME: fluoranylmethoxybenzene
MOLECULAR FORMULA: C7H7FO
MOLECULAR WEIGHT: 126.128283
SMILES: C1=CC=C(C=C1)OCF
Structure:
CAS RN: 15205-62-6
CAS Name: phosphorous acid tritert-butyl ester
OPENEYE Name: tritert-butyl phosphite
IUPAC Name: tritert-butyl phosphite
SYSTEMATIC NAME: tritert-butyl phosphite
MOLECULAR FORMULA: C12H27O3P
MOLECULAR WEIGHT: 250.314741
SMILES: CC(C)(C)OP(OC(C)(C)C)OC(C)(C)C
Structure:
CAS RN: 4237-00-7
CAS Name: (dimethoxyphosphorylthio)benzene
OPENEYE Name: dimethoxyphosphorylsulfanylbenzene
IUPAC Name: dimethoxyphosphorylsulfanylbenzene
SYSTEMATIC NAME: dimethoxyphosphorylsulfanylbenzene
MOLECULAR FORMULA: C8H11O3PS
MOLECULAR WEIGHT: 218.209901
SMILES: COP(=O)(OC)SC1=CC=CC=C1
Structure:
CAS RN: 54815-45-1
CAS Name: benzenesulfenic acid ethyl ester
OPENEYE Name: ethoxysulfanylbenzene
IUPAC Name: ethoxysulfanylbenzene
SYSTEMATIC NAME: ethoxysulfanylbenzene
MOLECULAR FORMULA: C8H10OS
MOLECULAR WEIGHT: 154.2294
SMILES: CCOSC1=CC=CC=C1
Structure:
CAS RN: 14540-52-4
CAS Name: phosphorous acid tris(2,2-dimethylpropyl) ester
OPENEYE Name: tris(2,2-dimethylpropyl) phosphite
IUPAC Name: tris(2,2-dimethylpropyl) phosphite
SYSTEMATIC NAME: tris(2,2-dimethylpropyl) phosphite
MOLECULAR FORMULA: C15H33O3P
MOLECULAR WEIGHT: 292.394481
SMILES: CC(C)(C)COP(OCC(C)(C)C)OCC(C)(C)C
Structure:
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