CAS RN: 15856-34-5
CAS Name: 1,4,8,11-tetrathiadispiro[4.1.4^{7}.3^{5}]tetradecan-13-ol
OPENEYE Name: 1,4,8,11-tetrathiadispiro[4.1.4^{7}.3^{5}]tetradecan-13-ol
IUPAC Name: 1,4,8,11-tetrathiadispiro[4.1.4^{7}.3^{5}]tetradecan-13-ol
SYSTEMATIC NAME: 1,4,8,11-tetrathiadispiro[4.1.4^{7}.3^{5}]tetradecan-13-ol
MOLECULAR FORMULA: C10H16OS4
MOLECULAR WEIGHT: 280.49344
SMILES: C1CSC2(S1)CC(CC3(C2)SCCS3)O
Structure:
CAS RN: 7490-36-0
CAS Name: 1,4,8,11-tetrathiadispiro[4.1.4^{7}.3^{5}]tetradecane
OPENEYE Name: 1,4,8,11-tetrathiadispiro[4.1.4^{7}.3^{5}]tetradecane
IUPAC Name: 1,4,8,11-tetrathiadispiro[4.1.4^{7}.3^{5}]tetradecane
SYSTEMATIC NAME: 1,4,8,11-tetrathiadispiro[4.1.4^{7}.3^{5}]tetradecane
MOLECULAR FORMULA: C10H16S4
MOLECULAR WEIGHT: 264.49404
SMILES: C1CC2(CC3(C1)SCCS3)SCCS2
Structure:
CAS RN: 762-38-9
CAS Name: 10-hydroxy-3-oxodecanenitrile
OPENEYE Name: 10-hydroxy-3-oxo-decanenitrile
IUPAC Name: 10-hydroxy-3-oxodecanenitrile
SYSTEMATIC NAME: 10-oxidanyl-3-oxidanylidene-decanenitrile
MOLECULAR FORMULA: C10H17NO2
MOLECULAR WEIGHT: 183.24748
SMILES: C(CCCC(=O)CC#N)CCCO
Structure:
CAS RN: 13937-10-5
CAS Name: 2-(1-hydroxybutyl)propanedioic acid diethyl ester
OPENEYE Name: diethyl 2-(1-hydroxybutyl)propanedioate
IUPAC Name: diethyl 2-(1-hydroxybutyl)propanedioate
SYSTEMATIC NAME: diethyl 2-(1-oxidanylbutyl)propanedioate
MOLECULAR FORMULA: C11H20O5
MOLECULAR WEIGHT: 232.2735
SMILES: CCCC(C(C(=O)OCC)C(=O)OCC)O
Structure:
CAS RN: 83120-70-1
CAS Name: 3,5-dihydroxypentanoic acid
OPENEYE Name: 3,5-dihydroxypentanoic acid
IUPAC Name: 3,5-dihydroxypentanoic acid
SYSTEMATIC NAME: 3,5-bis(oxidanyl)pentanoic acid
MOLECULAR FORMULA: C5H10O4
MOLECULAR WEIGHT: 134.1305
SMILES: C(CO)C(CC(=O)O)O
Structure:
CAS RN: 23853-42-1
CAS Name: benzenecarbothioic acid S-(benzenesulfonamidomethyl) ester
OPENEYE Name: S-(benzenesulfonamidomethyl) benzenecarbothioate
IUPAC Name: S-(benzenesulfonamidomethyl) benzenecarbothioate
SYSTEMATIC NAME: S-(phenylsulfonylaminomethyl) benzenecarbothioate
MOLECULAR FORMULA: C14H13NO3S2
MOLECULAR WEIGHT: 307.38792
SMILES: C1=CC=C(C=C1)C(=O)SCNS(=O)(=O)C2=CC=CC=C2
Structure:
CAS RN: 23853-45-4
CAS Name: ethanethioic acid S-[(2,6-dioxocyclohexyl)methyl] ester
OPENEYE Name: S-[(2,6-dioxocyclohexyl)methyl] ethanethioate
IUPAC Name: S-[(2,6-dioxocyclohexyl)methyl] ethanethioate
SYSTEMATIC NAME: S-[[2,6-bis(oxidanylidene)cyclohexyl]methyl] ethanethioate
MOLECULAR FORMULA: C9H12O3S
MOLECULAR WEIGHT: 200.25478
SMILES: CC(=O)SCC1C(=O)CCCC1=O
Structure:
CAS RN: 23853-44-3
CAS Name: ethanethioic acid S-[(4,4-dimethyl-2,6-dioxocyclohexyl)methyl] ester
OPENEYE Name: S-[(4,4-dimethyl-2,6-dioxo-cyclohexyl)methyl] ethanethioate
IUPAC Name: S-[(4,4-dimethyl-2,6-dioxocyclohexyl)methyl] ethanethioate
SYSTEMATIC NAME: S-[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexyl]methyl] ethanethioate
MOLECULAR FORMULA: C11H16O3S
MOLECULAR WEIGHT: 228.30794
SMILES: CC(=O)SCC1C(=O)CC(CC1=O)(C)C
Structure:
CAS RN: 1142-51-4
CAS Name: 6-heptenoic acid; phenylhydrazine
OPENEYE Name: hept-6-enoic acid; phenylhydrazine
IUPAC Name: hept-6-enoic acid; phenylhydrazine
SYSTEMATIC NAME: hept-6-enoic acid; phenyldiazane
MOLECULAR FORMULA: C13H20N2O2
MOLECULAR WEIGHT: 236.3101
SMILES: C=CCCCCC(=O)O.C1=CC=C(C=C1)NN
Structure:
CAS RN: 23853-41-0
CAS Name: benzenecarbothioic acid S-[3-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenylpropyl] ester
OPENEYE Name: S-[3-[(2,4-dinitrophenyl)hydrazono]-2-phenyl-propyl] benzenecarbothioate
IUPAC Name: S-[3-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenylpropyl] benzenecarbothioate
SYSTEMATIC NAME: S-[3-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-propyl] benzenecarbothioate
MOLECULAR FORMULA: C22H18N4O5S
MOLECULAR WEIGHT: 450.46712
SMILES: C1=CC=C(C=C1)C(CSC(=O)C2=CC=CC=C2)C=NNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 23853-46-5
CAS Name: 5,5-dimethyl-2-[(phenylthio)methyl]cyclohexane-1,3-dione
OPENEYE Name: 5,5-dimethyl-2-(phenylsulfanylmethyl)cyclohexane-1,3-dione
IUPAC Name: 5,5-dimethyl-2-(phenylsulfanylmethyl)cyclohexane-1,3-dione
SYSTEMATIC NAME: 5,5-dimethyl-2-(phenylsulfanylmethyl)cyclohexane-1,3-dione
MOLECULAR FORMULA: C15H18O2S
MOLECULAR WEIGHT: 262.36722
SMILES: CC1(CC(=O)C(C(=O)C1)CSC2=CC=CC=C2)C
Structure:
CAS RN: 23853-39-6
CAS Name: benzenecarbothioic acid S-[(4,4-dimethyl-2,6-dioxocyclohexyl)methyl] ester
OPENEYE Name: S-[(4,4-dimethyl-2,6-dioxo-cyclohexyl)methyl] benzenecarbothioate
IUPAC Name: S-[(4,4-dimethyl-2,6-dioxocyclohexyl)methyl] benzenecarbothioate
SYSTEMATIC NAME: S-[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexyl]methyl] benzenecarbothioate
MOLECULAR FORMULA: C16H18O3S
MOLECULAR WEIGHT: 290.37732
SMILES: CC1(CC(=O)C(C(=O)C1)CSC(=O)C2=CC=CC=C2)C
Structure:
CAS RN: 33837-56-8
CAS Name: acetic acid 1-(2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-yl ester
OPENEYE Name: [2-(5-allyl-2,4,6-trioxo-hexahydropyrimidin-5-yl)-1-methyl-ethyl] acetate
IUPAC Name: 1-(2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-yl acetate
SYSTEMATIC NAME: 1-[2,4,6-tris(oxidanylidene)-5-prop-2-enyl-1,3-diazinan-5-yl]propan-2-yl ethanoate
MOLECULAR FORMULA: C12H16N2O5
MOLECULAR WEIGHT: 268.26584
SMILES: CC(CC1(C(=O)NC(=O)NC1=O)CC=C)OC(=O)C
Structure:
CAS RN: 41419-12-9
CAS Name: 3,3-dichloro-2-piperidinone
OPENEYE Name: 3,3-dichloropiperidin-2-one
IUPAC Name: 3,3-dichloropiperidin-2-one
SYSTEMATIC NAME: 3,3-bis(chloranyl)piperidin-2-one
MOLECULAR FORMULA: C5H7Cl2NO
MOLECULAR WEIGHT: 168.02118
SMILES: C1CC(C(=O)NC1)(Cl)Cl
Structure:
CAS RN: 73746-43-7
CAS Name: 2-iodo-5-methyl-1H-imidazole
OPENEYE Name: 2-iodo-5-methyl-1H-imidazole
IUPAC Name: 2-iodo-5-methyl-1H-imidazole
SYSTEMATIC NAME: 2-iodanyl-5-methyl-1H-imidazole
MOLECULAR FORMULA: C4H5IN2
MOLECULAR WEIGHT: 208.00037
SMILES: CC1=CN=C(N1)I
Structure:
CAS RN: 93689-13-5
CAS Name: 5-methyl-1H-imidazol-2-amine; 2,4,6-trinitrophenol
OPENEYE Name: 5-methyl-1H-imidazol-2-amine; picric acid
IUPAC Name: 5-methyl-1H-imidazol-2-amine; 2,4,6-trinitrophenol
SYSTEMATIC NAME: 5-methyl-1H-imidazol-2-amine; 2,4,6-trinitrophenol
MOLECULAR FORMULA: C10H10N6O7
MOLECULAR WEIGHT: 326.2224
SMILES: CC1=CN=C(N1)N.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 5899-21-8
CAS Name: (3-hydroxy-1-methyl-3-piperidinyl)-phenylmethanone
OPENEYE Name: (3-hydroxy-1-methyl-3-piperidyl)-phenyl-methanone
IUPAC Name: (3-hydroxy-1-methylpiperidin-3-yl)-phenylmethanone
SYSTEMATIC NAME: (1-methyl-3-oxidanyl-piperidin-3-yl)-phenyl-methanone
MOLECULAR FORMULA: C13H17NO2
MOLECULAR WEIGHT: 219.27958
SMILES: CN1CCCC(C1)(C(=O)C2=CC=CC=C2)O
Structure:
CAS RN: 93431-10-8
CAS Name: (4-hydroxy-1-methyl-4-piperidinyl)-phenylmethanone
OPENEYE Name: (4-hydroxy-1-methyl-4-piperidyl)-phenyl-methanone
IUPAC Name: (4-hydroxy-1-methylpiperidin-4-yl)-phenylmethanone
SYSTEMATIC NAME: (1-methyl-4-oxidanyl-piperidin-4-yl)-phenyl-methanone
MOLECULAR FORMULA: C13H17NO2
MOLECULAR WEIGHT: 219.27958
SMILES: CN1CCC(CC1)(C(=O)C2=CC=CC=C2)O
Structure:
CAS RN: 58481-06-4
CAS Name: 2-phenyl-4-pyridinecarbohydrazide
OPENEYE Name: 2-phenylpyridine-4-carbohydrazide
IUPAC Name: 2-phenylpyridine-4-carbohydrazide
SYSTEMATIC NAME: 2-phenylpyridine-4-carbohydrazide
MOLECULAR FORMULA: C12H11N3O
MOLECULAR WEIGHT: 213.23524
SMILES: C1=CC=C(C=C1)C2=NC=CC(=C2)C(=O)NN
Structure:
CAS RN: 369-24-4
CAS Name: 2-fluoro-4-pyridinecarbohydrazide
OPENEYE Name: 2-fluoropyridine-4-carbohydrazide
IUPAC Name: 2-fluoropyridine-4-carbohydrazide
SYSTEMATIC NAME: 2-fluoranylpyridine-4-carbohydrazide
MOLECULAR FORMULA: C6H6FN3O
MOLECULAR WEIGHT: 155.129743
SMILES: C1=CN=C(C=C1C(=O)NN)F
Structure:
CAS RN: 58481-01-9
CAS Name: 2-amino-4-pyridinecarbohydrazide
OPENEYE Name: 2-aminopyridine-4-carbohydrazide
IUPAC Name: 2-aminopyridine-4-carbohydrazide
SYSTEMATIC NAME: 2-azanylpyridine-4-carbohydrazide
MOLECULAR FORMULA: C6H8N4O
MOLECULAR WEIGHT: 152.15392
SMILES: C1=CN=C(C=C1C(=O)NN)N
Structure:
CAS RN: 19353-97-0
CAS Name: 2-methoxy-4-pyridinecarbohydrazide
OPENEYE Name: 2-methoxypyridine-4-carbohydrazide
IUPAC Name: 2-methoxypyridine-4-carbohydrazide
SYSTEMATIC NAME: 2-methoxypyridine-4-carbohydrazide
MOLECULAR FORMULA: C7H9N3O2
MOLECULAR WEIGHT: 167.16526
SMILES: COC1=NC=CC(=C1)C(=O)NN
Structure:
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