CAS RN: 51732-68-4
CAS Name: 2-butylphenol; formaldehyde; phenol
OPENEYE Name: 2-butylphenol; formaldehyde; phenol
IUPAC Name: 2-butylphenol; formaldehyde; phenol
SYSTEMATIC NAME: 2-butylphenol; methanal; phenol
MOLECULAR FORMULA: C17H22O3
MOLECULAR WEIGHT: 274.35478
SMILES: CCCCC1=CC=CC=C1O.C=O.C1=CC=C(C=C1)O
Structure:
CAS RN: 51678-15-0
CAS Name: 2-(5-thiophen-2-yl-2-selenophenyl)thiophene
OPENEYE Name: 2-[5-(2-thienyl)selenophen-2-yl]thiophene
IUPAC Name: 2-(5-thiophen-2-ylselenophen-2-yl)thiophene
SYSTEMATIC NAME: 2-(5-thiophen-2-ylselenophen-2-yl)thiophene
MOLECULAR FORMULA: C12H8S2Se
MOLECULAR WEIGHT: 295.28192
SMILES: C1=CSC(=C1)C2=CC=C([Se]2)C3=CC=CS3
Structure:
CAS RN: 51670-40-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C25H30O8
MOLECULAR WEIGHT: 458.5009
SMILES: C[C@@H]1CC2=CC(=C(C(=C2C3=C(C4=C(C=C3[C@@H]([C@@H]1C)OC(=O)C)OCO4)OC)OC)OC)OC
Structure:
CAS RN: 51668-30-5
CAS Name: 2-methyloxirane; octadecanoic acid; oxirane
OPENEYE Name: 2-methyloxirane; oxirane; stearic acid
IUPAC Name: 2-methyloxirane; octadecanoic acid; oxirane
SYSTEMATIC NAME: 2-methyloxirane; octadecanoic acid; oxirane
MOLECULAR FORMULA: C23H46O4
MOLECULAR WEIGHT: 386.60894
SMILES: CCCCCCCCCCCCCCCCCC(=O)O.CC1CO1.C1CO1
Structure:
CAS RN: 57534-60-8
CAS Name: 2-methyloxirane; octadecanoic acid; oxirane
OPENEYE Name: 2-methyloxirane; oxirane; stearic acid
IUPAC Name: 2-methyloxirane; octadecanoic acid; oxirane
SYSTEMATIC NAME: 2-methyloxirane; octadecanoic acid; oxirane
MOLECULAR FORMULA: C23H46O4
MOLECULAR WEIGHT: 386.60894
SMILES: CCCCCCCCCCCCCCCCCC(=O)O.CC1CO1.C1CO1
Structure:
CAS RN: 51621-00-2
CAS Name: 1-methyl-4,7-diphenyl-1,10-phenanthrolin-1-ium chloride
OPENEYE Name: 1-methyl-4,7-diphenyl-1,10-phenanthrolin-1-ium chloride
IUPAC Name: 1-methyl-4,7-diphenyl-1,10-phenanthrolin-1-ium chloride
SYSTEMATIC NAME: 1-methyl-4,7-diphenyl-1,10-phenanthrolin-1-ium chloride
MOLECULAR FORMULA: C25H19ClN2
MOLECULAR WEIGHT: 382.88476
SMILES: C[N+]1=C2C(=C(C=C1)C3=CC=CC=C3)C=CC4=C(C=CN=C42)C5=CC=CC=C5.[Cl-]
Structure:
CAS RN: 51620-99-6
CAS Name: 1,4,7-trimethyl-1,10-phenanthrolin-1-ium chloride
OPENEYE Name: 1,4,7-trimethyl-1,10-phenanthrolin-1-ium chloride
IUPAC Name: 1,4,7-trimethyl-1,10-phenanthrolin-1-ium chloride
SYSTEMATIC NAME: 1,4,7-trimethyl-1,10-phenanthrolin-1-ium chloride
MOLECULAR FORMULA: C15H15ClN2
MOLECULAR WEIGHT: 258.746
SMILES: CC1=C2C=CC3=C(C=C[N+](=C3C2=NC=C1)C)C.[Cl-]
Structure:
CAS RN: 51605-68-6
CAS Name: 3-pyridinecarboxylic acid [2,7,8-trimethyl-6-[oxo(3-pyridinyl)methoxy]-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-5-yl]methyl ester
OPENEYE Name: [2,7,8-trimethyl-6-(pyridine-3-carbonyloxy)-2-(4,8,12-trimethyltridecyl)chroman-5-yl]methyl pyridine-3-carboxylate
IUPAC Name: [2,7,8-trimethyl-6-(pyridine-3-carbonyloxy)-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-5-yl]methyl pyridine-3-carboxylate
SYSTEMATIC NAME: [2,7,8-trimethyl-6-pyridin-3-ylcarbonyloxy-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-5-yl]methyl pyridine-3-carboxylate
MOLECULAR FORMULA: C41H56N2O5
MOLECULAR WEIGHT: 656.89374
SMILES: CC1=C2C(=C(C(=C1C)OC(=O)C3=CN=CC=C3)COC(=O)C4=CN=CC=C4)CCC(O2)(C)CCCC(C)CCCC(C)CCCC(C)C
Structure:
CAS RN: 51602-05-2
CAS Name: 6-chloro-N4-ethyl-N2-propan-2-yl-1,3,5-triazine-2,4-diamine; 2-(2,4,5-trichlorophenoxy)ethanol
OPENEYE Name: 6-chloro-N4-ethyl-N2-isopropyl-1,3,5-triazine-2,4-diamine; 2-(2,4,5-trichlorophenoxy)ethanol
IUPAC Name: 6-chloro-4-N-ethyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine; 2-(2,4,5-trichlorophenoxy)ethanol
SYSTEMATIC NAME: 6-chloranyl-N4-ethyl-N2-propan-2-yl-1,3,5-triazine-2,4-diamine; 2-[2,4,5-tris(chloranyl)phenoxy]ethanol
MOLECULAR FORMULA: C16H21Cl4N5O2
MOLECULAR WEIGHT: 457.18224
SMILES: CCNC1=NC(=NC(=N1)Cl)NC(C)C.C1=C(C(=CC(=C1Cl)Cl)Cl)OCCO
Structure:
CAS RN: 51599-32-7
CAS Name: N-[5-[[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]-4,4-dimethyl-3-oxo-2-[(1-phenyl-5-tetrazolyl)thio]pentanamide
OPENEYE Name: N-[5-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butanoylamino]-2-chloro-phenyl]-4,4-dimethyl-3-oxo-2-(1-phenyltetrazol-5-yl)sulfanyl-pentanamide
IUPAC Name: N-[5-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoylamino]-2-chlorophenyl]-4,4-dimethyl-3-oxo-2-(1-phenyltetrazol-5-yl)sulfanylpentanamide
SYSTEMATIC NAME: N-[5-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoylamino]-2-chloranyl-phenyl]-4,4-dimethyl-3-oxidanylidene-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]pentanamide
MOLECULAR FORMULA: C40H51ClN6O4S
MOLECULAR WEIGHT: 747.38874
SMILES: CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)NC(=O)C(C(=O)C(C)(C)C)SC3=NN=NN3C4=CC=CC=C4)C(C)(C)CC
Structure:
CAS RN: 51580-99-5
CAS Name: 3-(5-oxo-2-isoxazolyl)propanenitrile
OPENEYE Name: 3-(5-oxoisoxazol-2-yl)propanenitrile
IUPAC Name: 3-(5-oxo-1,2-oxazol-2-yl)propanenitrile
SYSTEMATIC NAME: 3-(5-oxidanylidene-1,2-oxazol-2-yl)propanenitrile
MOLECULAR FORMULA: C6H6N2O2
MOLECULAR WEIGHT: 138.12404
SMILES: C1=CN(OC1=O)CCC#N
Structure:
CAS RN: 51550-40-4
CAS Name: N-(2,4-dimethylphenyl)-N'-methylmethanimidamide hydrochloride
OPENEYE Name: N-(2,4-dimethylphenyl)-N'-methyl-formamidine hydrochloride
IUPAC Name: N-(2,4-dimethylphenyl)-N'-methylmethanimidamide hydrochloride
SYSTEMATIC NAME: N-(2,4-dimethylphenyl)-N'-methyl-methanimidamide hydrochloride
MOLECULAR FORMULA: C10H15ClN2
MOLECULAR WEIGHT: 198.6925
SMILES: CC1=CC(=C(C=C1)NC=NC)C.Cl
Structure:
CAS RN: 51528-03-1
CAS Name: N-(dimethyl-$l^{4}-sulfanylidene)-4-(dipropylamino)-3,5-dinitrobenzenesulfonamide
OPENEYE Name: N-(dimethyl-$l^{4}-sulfanylidene)-4-(dipropylamino)-3,5-dinitro-benzenesulfonamide
IUPAC Name: N-(dimethyl-$l^{4}-sulfanylidene)-4-(dipropylamino)-3,5-dinitrobenzenesulfonamide
SYSTEMATIC NAME: N-(dimethyl-$l^{4}-sulfanylidene)-4-(dipropylamino)-3,5-dinitro-benzenesulfonamide
MOLECULAR FORMULA: C14H22N4O6S2
MOLECULAR WEIGHT: 406.47768
SMILES: CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N=S(C)C)[N+](=O)[O-]
Structure:
CAS RN: 51501-27-0
CAS Name: N-(1H-indol-7-yl)-1-hexadecanesulfonamide
OPENEYE Name: N-(1H-indol-7-yl)hexadecane-1-sulfonamide
IUPAC Name: N-(1H-indol-7-yl)hexadecane-1-sulfonamide
SYSTEMATIC NAME: N-(1H-indol-7-yl)hexadecane-1-sulfonamide
MOLECULAR FORMULA: C24H40N2O2S
MOLECULAR WEIGHT: 420.6516
SMILES: CCCCCCCCCCCCCCCCS(=O)(=O)NC1=CC=CC2=C1NC=C2
Structure:
CAS RN: 51486-54-5
CAS Name: 4-propyl-1-sulfanylidene-2,6,7-trioxa-1$l^{5}-phosphabicyclo[2.2.2]octane
OPENEYE Name: 4-propyl-1-thioxo-2,6,7-trioxa-1$l^{5}-phosphabicyclo[2.2.2]octane
IUPAC Name: 4-propyl-1-sulfanylidene-2,6,7-trioxa-1$l^{5}-phosphabicyclo[2.2.2]octane
SYSTEMATIC NAME: 4-propyl-1-sulfanylidene-2,6,7-trioxa-1$l^{5}-phosphabicyclo[2.2.2]octane
MOLECULAR FORMULA: C7H13O3PS
MOLECULAR WEIGHT: 208.215081
SMILES: CCCC12COP(=S)(OC1)OC2
Structure:
CAS RN: 51475-16-2
CAS Name: N-ethyl-3-methyl-N-[2-(1-pyridin-1-iumyl)ethyl]aniline chloride
OPENEYE Name: N-ethyl-3-methyl-N-(2-pyridin-1-ium-1-ylethyl)aniline chloride
IUPAC Name: N-ethyl-3-methyl-N-(2-pyridin-1-ium-1-ylethyl)aniline chloride
SYSTEMATIC NAME: N-ethyl-3-methyl-N-(2-pyridin-1-ium-1-ylethyl)aniline chloride
MOLECULAR FORMULA: C16H21ClN2
MOLECULAR WEIGHT: 276.80434
SMILES: CCN(CC[N+]1=CC=CC=C1)C2=CC=CC(=C2)C.[Cl-]
Structure:
CAS RN: 51473-24-6
CAS Name: tetradecanoic acid 8-methylnonyl ester
OPENEYE Name: 8-methylnonyl tetradecanoate
IUPAC Name: 8-methylnonyl tetradecanoate
SYSTEMATIC NAME: 8-methylnonyl tetradecanoate
MOLECULAR FORMULA: C24H48O2
MOLECULAR WEIGHT: 368.63672
SMILES: CCCCCCCCCCCCCC(=O)OCCCCCCCC(C)C
Structure:
CAS RN: 51461-11-1
CAS Name: N-(3-amino-4-chlorophenyl)-4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanamide
OPENEYE Name: N-(3-amino-4-chloro-phenyl)-4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butanamide
IUPAC Name: N-(3-amino-4-chlorophenyl)-4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanamide
SYSTEMATIC NAME: N-(3-azanyl-4-chloranyl-phenyl)-4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanamide
MOLECULAR FORMULA: C26H37ClN2O2
MOLECULAR WEIGHT: 445.03718
SMILES: CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)N)C(C)(C)CC
Structure:
CAS RN: 51436-99-8
CAS Name: 4-bromo-2-fluoro-1-methylbenzene
OPENEYE Name: 4-bromo-2-fluoro-1-methyl-benzene
IUPAC Name: 4-bromo-2-fluoro-1-methylbenzene
SYSTEMATIC NAME: 4-bromanyl-2-fluoranyl-1-methyl-benzene
MOLECULAR FORMULA: C7H6BrF
MOLECULAR WEIGHT: 189.024943
SMILES: CC1=C(C=C(C=C1)Br)F
Structure:
CAS RN: 51394-31-1
CAS Name: 4-amino-6-tert-butyl-3-(methylthio)-1,2,4-triazin-5-one; 2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline
OPENEYE Name: 4-amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one; 2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline
IUPAC Name: 4-amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one; 2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline
SYSTEMATIC NAME: 4-azanyl-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one; 2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline
MOLECULAR FORMULA: C21H30F3N7O5S
MOLECULAR WEIGHT: 549.56701
SMILES: CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-].CC(C)(C)C1=NN=C(N(C1=O)N)SC
Structure:
CAS RN: 51683-16-0
CAS Name: 4-amino-6-tert-butyl-3-(methylthio)-1,2,4-triazin-5-one; 2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline
OPENEYE Name: 4-amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one; 2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline
IUPAC Name: 4-amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one; 2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline
SYSTEMATIC NAME: 4-azanyl-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one; 2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline
MOLECULAR FORMULA: C21H30F3N7O5S
MOLECULAR WEIGHT: 549.56701
SMILES: CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-].CC(C)(C)C1=NN=C(N(C1=O)N)SC
Structure:
CAS RN: 53468-33-0
CAS Name: 4-amino-6-tert-butyl-3-(methylthio)-1,2,4-triazin-5-one; 2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline
OPENEYE Name: 4-amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one; 2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline
IUPAC Name: 4-amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one; 2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline
SYSTEMATIC NAME: 4-azanyl-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one; 2,6-dinitro-N,N-dipropyl-4-(trifluoromethyl)aniline
MOLECULAR FORMULA: C21H30F3N7O5S
MOLECULAR WEIGHT: 549.56701
SMILES: CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-].CC(C)(C)C1=NN=C(N(C1=O)N)SC
Structure:
CAS RN: 51391-98-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C11H13ClIN3O5
MOLECULAR WEIGHT: 429.59549
SMILES: CC(=O)O[C@@H]1[C@H](O[C@@H]2[C@H]1OC3=NC(=N)C(=CN23)I)CO.Cl
Structure:
CAS RN: 51390-22-8
CAS Name: acetic acid; 1,4-diazabicyclo[2.2.2]octane
OPENEYE Name: acetic acid; 1,4-diazabicyclo[2.2.2]octane
IUPAC Name: acetic acid; 1,4-diazabicyclo[2.2.2]octane
SYSTEMATIC NAME: 1,4-diazabicyclo[2.2.2]octane; ethanoic acid
MOLECULAR FORMULA: C10H20N2O4
MOLECULAR WEIGHT: 232.2768
SMILES: CC(=O)O.CC(=O)O.C1CN2CCN1CC2
Structure:
CAS RN: 51375-22-5
CAS Name: 2-[[9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-purinyl]thio]-1-phenylethanone
OPENEYE Name: 2-[9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purin-6-yl]sulfanyl-1-phenyl-ethanone
IUPAC Name: 2-[9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]sulfanyl-1-phenylethanone
SYSTEMATIC NAME: 2-[9-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-6-yl]sulfanyl-1-phenyl-ethanone
MOLECULAR FORMULA: C18H18N4O5S
MOLECULAR WEIGHT: 402.42432
SMILES: C1=CC=C(C=C1)C(=O)CSC2=NC=NC3=C2N=CN3[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O
Structure:
CAS RN: 51375-21-4
CAS Name: (2R,3R,4S,5R)-2-[6-[(4-chlorophenyl)methylthio]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol
OPENEYE Name: (2R,3R,4S,5R)-2-[6-[(4-chlorophenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
IUPAC Name: (2R,3R,4S,5R)-2-[6-[(4-chlorophenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
SYSTEMATIC NAME: (2R,3R,4S,5R)-2-[6-[(4-chlorophenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
MOLECULAR FORMULA: C17H17ClN4O4S
MOLECULAR WEIGHT: 408.85928
SMILES: C1=CC(=CC=C1CSC2=NC=NC3=C2N=CN3[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)Cl
Structure:
CAS RN: 51372-90-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H20O8
MOLECULAR WEIGHT: 328.3145
SMILES: CC1CC(C2(C13CC(C(C24COC4=O)(C)O)OC(=O)C3O)O)O
Structure:
CAS RN: 51368-18-4
CAS Name: (2S,3R,4S,5R,6R)-2-(4-azidophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
OPENEYE Name: (2S,3R,4S,5R,6R)-2-(4-azidophenoxy)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
IUPAC Name: (2S,3R,4S,5R,6R)-2-(4-azidophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
SYSTEMATIC NAME: (2S,3R,4S,5R,6R)-2-(4-azidophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
MOLECULAR FORMULA: C12H15N3O6
MOLECULAR WEIGHT: 297.264
SMILES: C1=CC(=CC=C1N=[N+]=[N-])O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O
Structure:
CAS RN: 51365-22-1
CAS Name: 2-diethylphosphinoethanethiolate; gold(1+)
OPENEYE Name: 2-diethylphosphanylethanethiolate; gold(1+)
IUPAC Name: 2-diethylphosphanylethanethiolate; gold(1+)
SYSTEMATIC NAME: 2-diethylphosphanylethanethiolate; gold(1+)
MOLECULAR FORMULA: C12H28Au2P2S2
MOLECULAR WEIGHT: 692.361342
SMILES: CCP(CC)CC[S-].CCP(CC)CC[S-].[Au+].[Au+]
Structure:
CAS RN: 51365-12-9
CAS Name: azacyclotridecan-2-one; 2-azepanone; hexane-1,6-diamine; hexanedioic acid
OPENEYE Name: adipic acid; azacyclotridecan-2-one; azepan-2-one; hexane-1,6-diamine
IUPAC Name: azacyclotridecan-2-one; azepan-2-one; hexane-1,6-diamine; hexanedioic acid
SYSTEMATIC NAME: 1-azacyclotridecan-2-one; azepan-2-one; hexane-1,6-diamine; hexanedioic acid
MOLECULAR FORMULA: C30H60N4O6
MOLECULAR WEIGHT: 572.8206
SMILES: C1CCCCCC(=O)NCCCCC1.C1CCC(=O)NCC1.C(CCCN)CCN.C(CCC(=O)O)CC(=O)O
Structure:
CAS RN: 83740-03-8
CAS Name: azacyclotridecan-2-one; 2-azepanone; hexane-1,6-diamine; hexanedioic acid
OPENEYE Name: adipic acid; azacyclotridecan-2-one; azepan-2-one; hexane-1,6-diamine
IUPAC Name: azacyclotridecan-2-one; azepan-2-one; hexane-1,6-diamine; hexanedioic acid
SYSTEMATIC NAME: 1-azacyclotridecan-2-one; azepan-2-one; hexane-1,6-diamine; hexanedioic acid
MOLECULAR FORMULA: C30H60N4O6
MOLECULAR WEIGHT: 572.8206
SMILES: C1CCCCCC(=O)NCCCCC1.C1CCC(=O)NCC1.C(CCCN)CCN.C(CCC(=O)O)CC(=O)O
Structure:
CAS RN: 51349-86-1
CAS Name: sodium 5-nitrobenzimidazol-1-ide
OPENEYE Name: sodium 5-nitrobenzimidazol-1-ide
IUPAC Name: sodium 5-nitrobenzimidazol-1-ide
SYSTEMATIC NAME: sodium 5-nitrobenzimidazol-1-ide
MOLECULAR FORMULA: C7H4N3NaO2
MOLECULAR WEIGHT: 185.11533
SMILES: C1=CC2=C(C=C1[N+](=O)[O-])N=C[N-]2.[Na+]
Structure:
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