CAS RN: 54503-10-5
CAS Name: 2-carbamoyl-1-pyrrolidinecarboxylic acid tert-butyl ester
OPENEYE Name: tert-butyl 2-carbamoylpyrrolidine-1-carboxylate
IUPAC Name: tert-butyl 2-carbamoylpyrrolidine-1-carboxylate
SYSTEMATIC NAME: tert-butyl 2-aminocarbonylpyrrolidine-1-carboxylate
MOLECULAR FORMULA: C10H18N2O3
MOLECULAR WEIGHT: 214.26152
SMILES: CC(C)(C)OC(=O)N1CCCC1C(=O)N
Structure:
CAS RN: 54494-56-3
CAS Name: 2-[[8-(trifluoromethylthio)-4-quinolinyl]amino]benzoic acid 2,3-dihydroxypropyl ester hydrochloride
OPENEYE Name: 2,3-dihydroxypropyl 2-[[8-(trifluoromethylsulfanyl)-4-quinolyl]amino]benzoate hydrochloride
IUPAC Name: 2,3-dihydroxypropyl 2-[[8-(trifluoromethylsulfanyl)quinolin-4-yl]amino]benzoate hydrochloride
SYSTEMATIC NAME: 2,3-bis(oxidanyl)propyl 2-[[8-(trifluoromethylsulfanyl)quinolin-4-yl]amino]benzoate hydrochloride
MOLECULAR FORMULA: C20H18ClF3N2O4S
MOLECULAR WEIGHT: 474.88113
SMILES: C1=CC=C(C(=C1)C(=O)OCC(CO)O)NC2=C3C=CC=C(C3=NC=C2)SC(F)(F)F.Cl
Structure:
CAS RN: 54455-37-7
CAS Name: 2-(chloromethyl)-5-nitroisoindole-1,3-dione
OPENEYE Name: 2-(chloromethyl)-5-nitro-isoindoline-1,3-dione
IUPAC Name: 2-(chloromethyl)-5-nitroisoindole-1,3-dione
SYSTEMATIC NAME: 2-(chloromethyl)-5-nitro-isoindole-1,3-dione
MOLECULAR FORMULA: C9H5ClN2O4
MOLECULAR WEIGHT: 240.6
SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)CCl
Structure:
CAS RN: 54454-95-4
CAS Name: 1-(7-octyl-9,10-dihydrophenanthren-2-yl)-1-hexanone
OPENEYE Name: 1-(7-octyl-9,10-dihydrophenanthren-2-yl)hexan-1-one
IUPAC Name: 1-(7-octyl-9,10-dihydrophenanthren-2-yl)hexan-1-one
SYSTEMATIC NAME: 1-(7-octyl-9,10-dihydrophenanthren-2-yl)hexan-1-one
MOLECULAR FORMULA: C28H38O
MOLECULAR WEIGHT: 390.60072
SMILES: CCCCCCCCC1=CC2=C(C=C1)C3=C(CC2)C=C(C=C3)C(=O)CCCCC
Structure:
CAS RN: 54454-88-5
CAS Name: 1-(7-octyl-9,10-dihydrophenanthren-2-yl)-1-butanone
OPENEYE Name: 1-(7-octyl-9,10-dihydrophenanthren-2-yl)butan-1-one
IUPAC Name: 1-(7-octyl-9,10-dihydrophenanthren-2-yl)butan-1-one
SYSTEMATIC NAME: 1-(7-octyl-9,10-dihydrophenanthren-2-yl)butan-1-one
MOLECULAR FORMULA: C26H34O
MOLECULAR WEIGHT: 362.54756
SMILES: CCCCCCCCC1=CC2=C(C=C1)C3=C(CC2)C=C(C=C3)C(=O)CCC
Structure:
CAS RN: 54436-53-2
CAS Name: phosphoric acid (2,4-dinitrophenyl) diethyl ester
OPENEYE Name: (2,4-dinitrophenyl) diethyl phosphate
IUPAC Name: (2,4-dinitrophenyl) diethyl phosphate
SYSTEMATIC NAME: (2,4-dinitrophenyl) diethyl phosphate
MOLECULAR FORMULA: C10H13N2O8P
MOLECULAR WEIGHT: 320.192581
SMILES: CCOP(=O)(OCC)OC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 54398-84-4
CAS Name: 3-amino-5-methyl-1-cyclohex-2-enone
OPENEYE Name: 3-amino-5-methyl-cyclohex-2-en-1-one
IUPAC Name: 3-amino-5-methylcyclohex-2-en-1-one
SYSTEMATIC NAME: 3-azanyl-5-methyl-cyclohex-2-en-1-one
MOLECULAR FORMULA: C7H11NO
MOLECULAR WEIGHT: 125.16834
SMILES: CC1CC(=CC(=O)C1)N
Structure:
CAS RN: 54393-89-4
CAS Name: 2-nitro-4-(propylthio)aniline
OPENEYE Name: 2-nitro-4-propylsulfanyl-aniline
IUPAC Name: 2-nitro-4-propylsulfanylaniline
SYSTEMATIC NAME: 2-nitro-4-propylsulfanyl-aniline
MOLECULAR FORMULA: C9H12N2O2S
MOLECULAR WEIGHT: 212.26878
SMILES: CCCSC1=CC(=C(C=C1)N)[N+](=O)[O-]
Structure:
CAS RN: 54380-67-5
CAS Name: 3-(2-aminoethoxy)-1-propanamine
OPENEYE Name: 3-(2-aminoethoxy)propan-1-amine
IUPAC Name: 3-(2-aminoethoxy)propan-1-amine
SYSTEMATIC NAME: 3-(2-azanylethoxy)propan-1-amine
MOLECULAR FORMULA: C5H14N2O
MOLECULAR WEIGHT: 118.17746
SMILES: C(CN)COCCN
Structure:
CAS RN: 54363-79-0
CAS Name: 5-[(4-amino-1-naphthalenyl)azo]-2-anilinobenzenesulfonic acid
OPENEYE Name: 5-[(4-amino-1-naphthyl)azo]-2-anilino-benzenesulfonic acid
IUPAC Name: 5-[(4-aminonaphthalen-1-yl)diazenyl]-2-anilinobenzenesulfonic acid
SYSTEMATIC NAME: 5-[(4-azanylnaphthalen-1-yl)diazenyl]-2-phenylazanyl-benzenesulfonic acid
MOLECULAR FORMULA: C22H18N4O3S
MOLECULAR WEIGHT: 418.46832
SMILES: C1=CC=C(C=C1)NC2=C(C=C(C=C2)N=NC3=CC=C(C4=CC=CC=C43)N)S(=O)(=O)O
Structure:
CAS RN: 54354-14-2
CAS Name: 2-mercaptopropanal
OPENEYE Name: 2-sulfanylpropanal
IUPAC Name: 2-sulfanylpropanal
SYSTEMATIC NAME: 2-sulfanylpropanal
MOLECULAR FORMULA: C3H6OS
MOLECULAR WEIGHT: 90.14414
SMILES: CC(C=O)S
Structure:
CAS RN: 54322-29-1
CAS Name: 2-ethyl-1-nonanol
OPENEYE Name: 2-ethylnonan-1-ol
IUPAC Name: 2-ethylnonan-1-ol
SYSTEMATIC NAME: 2-ethylnonan-1-ol
MOLECULAR FORMULA: C11H24O
MOLECULAR WEIGHT: 172.30766
SMILES: CCCCCCCC(CC)CO
Structure:
CAS RN: 54303-30-9
CAS Name: 2-(ethylthio)ethanamine hydrochloride
OPENEYE Name: 2-ethylsulfanylethanamine hydrochloride
IUPAC Name: 2-ethylsulfanylethanamine hydrochloride
SYSTEMATIC NAME: 2-ethylsulfanylethanamine hydrochloride
MOLECULAR FORMULA: C4H12ClNS
MOLECULAR WEIGHT: 141.66278
SMILES: CCSCCN.Cl
Structure:
CAS RN: 54288-02-7
CAS Name: 5-phenyldiazenylpyrimidine-4,6-diamine
OPENEYE Name: 5-phenylazopyrimidine-4,6-diamine
IUPAC Name: 5-phenyldiazenylpyrimidine-4,6-diamine
SYSTEMATIC NAME: 5-phenyldiazenylpyrimidine-4,6-diamine
MOLECULAR FORMULA: C10H10N6
MOLECULAR WEIGHT: 214.2266
SMILES: C1=CC=C(C=C1)N=NC2=C(N=CN=C2N)N
Structure:
CAS RN: 54286-89-4
CAS Name: 1,1,6,6-tetramethoxyhexane
OPENEYE Name: 1,1,6,6-tetramethoxyhexane
IUPAC Name: 1,1,6,6-tetramethoxyhexane
SYSTEMATIC NAME: 1,1,6,6-tetramethoxyhexane
MOLECULAR FORMULA: C10H22O4
MOLECULAR WEIGHT: 206.27928
SMILES: COC(CCCCC(OC)OC)OC
Structure:
CAS RN: 54267-12-8
CAS Name: bis(methylsulfinyl)methane
OPENEYE Name: bis(methylsulfinyl)methane
IUPAC Name: bis(methylsulfinyl)methane
SYSTEMATIC NAME: bis(methylsulfinyl)methane
MOLECULAR FORMULA: C3H8O2S2
MOLECULAR WEIGHT: 140.22442
SMILES: CS(=O)CS(=O)C
Structure:
CAS RN: 54235-20-0
CAS Name: 3-nitro-2-fluoranthenol
OPENEYE Name: 3-nitrofluoranthen-2-ol
IUPAC Name: 3-nitrofluoranthen-2-ol
SYSTEMATIC NAME: 3-nitrofluoranthen-2-ol
MOLECULAR FORMULA: C16H9NO3
MOLECULAR WEIGHT: 263.24756
SMILES: C1=CC=C2C(=C1)C3=CC=CC4=C3C2=CC(=C4[N+](=O)[O-])O
Structure:
CAS RN: 54234-59-2
CAS Name: 2-(3,4-dihydroxyphenyl)acetyl chloride
OPENEYE Name: 2-(3,4-dihydroxyphenyl)acetyl chloride
IUPAC Name: 2-(3,4-dihydroxyphenyl)acetyl chloride
SYSTEMATIC NAME: 2-[3,4-bis(oxidanyl)phenyl]ethanoyl chloride
MOLECULAR FORMULA: C8H7ClO3
MOLECULAR WEIGHT: 186.59238
SMILES: C1=CC(=C(C=C1CC(=O)Cl)O)O
Structure:
CAS RN: 54167-06-5
CAS Name: 2,2-bis(2,6-dimethylphenyl)acetonitrile
OPENEYE Name: 2,2-bis(2,6-dimethylphenyl)acetonitrile
IUPAC Name: 2,2-bis(2,6-dimethylphenyl)acetonitrile
SYSTEMATIC NAME: 2,2-bis(2,6-dimethylphenyl)ethanenitrile
MOLECULAR FORMULA: C18H19N
MOLECULAR WEIGHT: 249.35016
SMILES: CC1=C(C(=CC=C1)C)C(C#N)C2=C(C=CC=C2C)C
Structure:
CAS RN: 54152-47-5
CAS Name: 2,2-dimethylpiperidine
OPENEYE Name: 2,2-dimethylpiperidine
IUPAC Name: 2,2-dimethylpiperidine
SYSTEMATIC NAME: 2,2-dimethylpiperidine
MOLECULAR FORMULA: C7H15N
MOLECULAR WEIGHT: 113.2007
SMILES: CC1(CCCCN1)C
Structure:
CAS RN: 54149-83-6
CAS Name: 1-(4-chlorophenyl)-2,2-diethoxyethanone
OPENEYE Name: 1-(4-chlorophenyl)-2,2-diethoxy-ethanone
IUPAC Name: 1-(4-chlorophenyl)-2,2-diethoxyethanone
SYSTEMATIC NAME: 1-(4-chlorophenyl)-2,2-diethoxy-ethanone
MOLECULAR FORMULA: C12H15ClO3
MOLECULAR WEIGHT: 242.6987
SMILES: CCOC(C(=O)C1=CC=C(C=C1)Cl)OCC
Structure:
CAS RN: 54119-71-0
CAS Name: 1-(8-ethoxy-4,8-dimethylnonyl)-4-propan-2-ylbenzene
OPENEYE Name: 1-(8-ethoxy-4,8-dimethyl-nonyl)-4-isopropyl-benzene
IUPAC Name: 1-(8-ethoxy-4,8-dimethylnonyl)-4-propan-2-ylbenzene
SYSTEMATIC NAME: 1-(8-ethoxy-4,8-dimethyl-nonyl)-4-propan-2-yl-benzene
MOLECULAR FORMULA: C22H38O
MOLECULAR WEIGHT: 318.53652
SMILES: CCOC(C)(C)CCCC(C)CCCC1=CC=C(C=C1)C(C)C
Structure:
CAS RN: 54119-29-8
CAS Name: 2,5-diethylpyridine
OPENEYE Name: 2,5-diethylpyridine
IUPAC Name: 2,5-diethylpyridine
SYSTEMATIC NAME: 2,5-diethylpyridine
MOLECULAR FORMULA: C9H13N
MOLECULAR WEIGHT: 135.20622
SMILES: CCC1=CN=C(C=C1)CC
Structure:
CAS RN: 54004-47-6
CAS Name: 1-tetradecylimidazole
OPENEYE Name: 1-tetradecylimidazole
IUPAC Name: 1-tetradecylimidazole
SYSTEMATIC NAME: 1-tetradecylimidazole
MOLECULAR FORMULA: C17H32N2
MOLECULAR WEIGHT: 264.44938
SMILES: CCCCCCCCCCCCCCN1C=CN=C1
Structure:
CAS RN: 53937-19-2
CAS Name: 3-(4-hydroxy-3-iodophenyl)propanoic acid
OPENEYE Name: 3-(4-hydroxy-3-iodo-phenyl)propanoic acid
IUPAC Name: 3-(4-hydroxy-3-iodophenyl)propanoic acid
SYSTEMATIC NAME: 3-(3-iodanyl-4-oxidanyl-phenyl)propanoic acid
MOLECULAR FORMULA: C9H9IO3
MOLECULAR WEIGHT: 292.07043
SMILES: C1=CC(=C(C=C1CCC(=O)O)I)O
Structure:
CAS RN: 53786-43-9
CAS Name: 4-amino-1-piperidinecarboxylic acid ethyl ester hydrochloride
OPENEYE Name: ethyl 4-aminopiperidine-1-carboxylate hydrochloride
IUPAC Name: ethyl 4-aminopiperidine-1-carboxylate hydrochloride
SYSTEMATIC NAME: ethyl 4-azanylpiperidine-1-carboxylate hydrochloride
MOLECULAR FORMULA: C8H17ClN2O2
MOLECULAR WEIGHT: 208.68578
SMILES: CCOC(=O)N1CCC(CC1)N.Cl
Structure:
CAS RN: 53754-71-5
CAS Name: 1,1-dimethyl-3,5-dimethylenepiperidin-1-ium chloride
OPENEYE Name: 1,1-dimethyl-3,5-dimethylene-piperidin-1-ium chloride
IUPAC Name: 1,1-dimethyl-3,5-dimethylidenepiperidin-1-ium chloride
SYSTEMATIC NAME: 1,1-dimethyl-3,5-dimethylidene-piperidin-1-ium chloride
MOLECULAR FORMULA: C9H16ClN
MOLECULAR WEIGHT: 173.68304
SMILES: C[N+]1(CC(=C)CC(=C)C1)C.[Cl-]
Structure:
CAS RN: 53719-45-2
CAS Name: 1,1,1-trifluoro-N-(3,4,5-trichlorophenyl)methanesulfonamide
OPENEYE Name: 1,1,1-trifluoro-N-(3,4,5-trichlorophenyl)methanesulfonamide
IUPAC Name: 1,1,1-trifluoro-N-(3,4,5-trichlorophenyl)methanesulfonamide
SYSTEMATIC NAME: 1,1,1-tris(fluoranyl)-N-[3,4,5-tris(chloranyl)phenyl]methanesulfonamide
MOLECULAR FORMULA: C7H3Cl3F3NO2S
MOLECULAR WEIGHT: 328.52343
SMILES: C1=C(C=C(C(=C1Cl)Cl)Cl)NS(=O)(=O)C(F)(F)F
Structure:
CAS RN: 53694-87-4
CAS Name: 1-azido-4-iodobenzene
OPENEYE Name: 1-azido-4-iodo-benzene
IUPAC Name: 1-azido-4-iodobenzene
SYSTEMATIC NAME: 1-azido-4-iodanyl-benzene
MOLECULAR FORMULA: C6H4IN3
MOLECULAR WEIGHT: 245.02053
SMILES: C1=CC(=CC=C1N=[N+]=[N-])I
Structure:
CAS RN: 53656-09-0
CAS Name: N-(2,6-dimethylphenyl)-1-(2-furanyl)methanimine
OPENEYE Name: N-(2,6-dimethylphenyl)-1-(2-furyl)methanimine
IUPAC Name: N-(2,6-dimethylphenyl)-1-(furan-2-yl)methanimine
SYSTEMATIC NAME: N-(2,6-dimethylphenyl)-1-(furan-2-yl)methanimine
MOLECULAR FORMULA: C13H13NO
MOLECULAR WEIGHT: 199.24842
SMILES: CC1=C(C(=CC=C1)C)N=CC2=CC=CO2
Structure:
CAS RN: 53654-12-9
CAS Name: 4-(4-morpholinyl)-4-piperidinecarboxamide
OPENEYE Name: 4-morpholinopiperidine-4-carboxamide
IUPAC Name: 4-morpholin-4-ylpiperidine-4-carboxamide
SYSTEMATIC NAME: 4-morpholin-4-ylpiperidine-4-carboxamide
MOLECULAR FORMULA: C10H19N3O2
MOLECULAR WEIGHT: 213.27676
SMILES: C1CNCCC1(C(=O)N)N2CCOCC2
Structure:
CAS RN: 53609-01-1
CAS Name: 5,8-dimethoxy-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
OPENEYE Name: 5,8-dimethoxy-6-methyl-tetralin-2-amine
IUPAC Name: 5,8-dimethoxy-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
SYSTEMATIC NAME: 5,8-dimethoxy-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
MOLECULAR FORMULA: C13H19NO2
MOLECULAR WEIGHT: 221.29546
SMILES: CC1=CC(=C2CC(CCC2=C1OC)N)OC
Structure:
No comments:
Post a Comment