CAS RN: 112984-60-8
CAS Name: 6-fluoro-1-methyl-4-oxo-7-(1-piperazinyl)-1H-[1,3]thiazeto[3,2-a]quinoline-3-carboxylic acid
OPENEYE Name: 6-fluoro-1-methyl-4-oxo-7-piperazin-1-yl-1H-[1,3]thiazeto[3,2-a]quinoline-3-carboxylic acid
IUPAC Name: 6-fluoro-1-methyl-4-oxo-7-piperazin-1-yl-1H-[1,3]thiazeto[3,2-a]quinoline-3-carboxylic acid
SYSTEMATIC NAME: 6-fluoranyl-1-methyl-4-oxidanylidene-7-piperazin-1-yl-1H-[1,3]thiazeto[3,2-a]quinoline-3-carboxylic acid
MOLECULAR FORMULA: C16H16FN3O3S
MOLECULAR WEIGHT: 349.379943
SMILES: CC1N2C3=CC(=C(C=C3C(=O)C(=C2S1)C(=O)O)F)N4CCNCC4
Structure:
CAS RN: 112953-13-6
CAS Name: (2S,5R)-5-hydroxy-2-(hydroxymethyl)-2,5,7-trimethyl-4-spiro[1H-indene-6,1'-cyclopropane]one
OPENEYE Name: (2S,5R)-5-hydroxy-2-(hydroxymethyl)-2,5,7-trimethyl-spiro[1H-indene-6,1'-cyclopropane]-4-one
IUPAC Name: (2S,5R)-5-hydroxy-2-(hydroxymethyl)-2,5,7-trimethylspiro[1H-indene-6,1'-cyclopropane]-4-one
SYSTEMATIC NAME: (2S,5R)-2-(hydroxymethyl)-2,5,7-trimethyl-5-oxidanyl-spiro[1H-indene-6,1'-cyclopropane]-4-one
MOLECULAR FORMULA: C15H20O3
MOLECULAR WEIGHT: 248.3175
SMILES: CC1=C2C[C@](C=C2C(=O)[C@](C13CC3)(C)O)(C)CO
Structure:
CAS RN: 112953-12-5
CAS Name: (5R)-5-hydroxy-2,2,5,7-tetramethyl-4-spiro[1H-indene-6,1'-cyclopropane]one
OPENEYE Name: (5R)-5-hydroxy-2,2,5,7-tetramethyl-spiro[1H-indene-6,1'-cyclopropane]-4-one
IUPAC Name: (5R)-5-hydroxy-2,2,5,7-tetramethylspiro[1H-indene-6,1'-cyclopropane]-4-one
SYSTEMATIC NAME: (5R)-2,2,5,7-tetramethyl-5-oxidanyl-spiro[1H-indene-6,1'-cyclopropane]-4-one
MOLECULAR FORMULA: C15H20O2
MOLECULAR WEIGHT: 232.3181
SMILES: CC1=C2CC(C=C2C(=O)[C@](C13CC3)(C)O)(C)C
Structure:
CAS RN: 76034-19-0
CAS Name: iron(2+); 2-propenoate
OPENEYE Name: ferrous prop-2-enoate
IUPAC Name: iron(2+); prop-2-enoate
SYSTEMATIC NAME: iron(2+); prop-2-enoate
MOLECULAR FORMULA: C6H6FeO4
MOLECULAR WEIGHT: 197.95444
SMILES: C=CC(=O)[O-].C=CC(=O)[O-].[Fe+2]
Structure:
CAS RN: 112892-80-5
CAS Name: N,N-dimethyl-2,3-dihydro-1H-phenalen-2-amine
OPENEYE Name: N,N-dimethyl-2,3-dihydro-1H-phenalen-2-amine
IUPAC Name: N,N-dimethyl-2,3-dihydro-1H-phenalen-2-amine
SYSTEMATIC NAME: N,N-dimethyl-2,3-dihydro-1H-phenalen-2-amine
MOLECULAR FORMULA: C15H17N
MOLECULAR WEIGHT: 211.30218
SMILES: CN(C)C1CC2=CC=CC3=C2C(=CC=C3)C1
Structure:
CAS RN: 103408-45-3
CAS Name: 1H-pyrimido[1,2-a]purin-10-one
OPENEYE Name: 1H-pyrimido[1,2-a]purin-10-one
IUPAC Name: 1H-pyrimido[1,2-a]purin-10-one
SYSTEMATIC NAME: 1H-pyrimido[1,2-a]purin-10-one
MOLECULAR FORMULA: C8H5N5O
MOLECULAR WEIGHT: 187.1582
SMILES: C1=CN2C(=O)C3=C(N=CN3)N=C2N=C1
Structure:
CAS RN: 103344-04-3
CAS Name: N1,N4-bis(3-methoxypropyl)benzo[g]phthalazine-1,4-diamine
OPENEYE Name: N1,N4-bis(3-methoxypropyl)benzo[g]phthalazine-1,4-diamine
IUPAC Name: 1-N,4-N-bis(3-methoxypropyl)benzo[g]phthalazine-1,4-diamine
SYSTEMATIC NAME: N1,N4-bis(3-methoxypropyl)benzo[g]phthalazine-1,4-diamine
MOLECULAR FORMULA: C20H26N4O2
MOLECULAR WEIGHT: 354.44604
SMILES: COCCCNC1=NN=C(C2=CC3=CC=CC=C3C=C21)NCCCOC
Structure:
CAS RN: 55084-08-7
CAS Name: 5-hydroxy-2-(2-hydroxy-6-methoxyphenyl)-6,7,8-trimethoxy-1-benzopyran-4-one
OPENEYE Name: 5-hydroxy-2-(2-hydroxy-6-methoxy-phenyl)-6,7,8-trimethoxy-chromen-4-one
IUPAC Name: 5-hydroxy-2-(2-hydroxy-6-methoxyphenyl)-6,7,8-trimethoxychromen-4-one
SYSTEMATIC NAME: 6,7,8-trimethoxy-2-(2-methoxy-6-oxidanyl-phenyl)-5-oxidanyl-chromen-4-one
MOLECULAR FORMULA: C19H18O8
MOLECULAR WEIGHT: 374.34142
SMILES: COC1=CC=CC(=C1C2=CC(=O)C3=C(O2)C(=C(C(=C3O)OC)OC)OC)O
Structure:
CAS RN: 56748-14-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C34H34O10
MOLECULAR WEIGHT: 602.62776
SMILES: C[C@@H]1[C@H]([C@]2([C@H]3[C@H]4[C@]1([C@@H]5C=C(C(=O)[C@]5([C@@H]([C@@]6([C@H]4O6)CO)O)O)C)O[C@@](O3)(O2)C7=CC=CC=C7)C(=C)C)OC(=O)C8=CC=CC=C8
Structure:
CAS RN: 55011-70-6
CAS Name: 4-amino-4-bicyclo[3.2.1]octanecarboxylic acid
OPENEYE Name: 4-aminobicyclo[3.2.1]octane-4-carboxylic acid
IUPAC Name: 4-aminobicyclo[3.2.1]octane-4-carboxylic acid
SYSTEMATIC NAME: 4-azanylbicyclo[3.2.1]octane-4-carboxylic acid
MOLECULAR FORMULA: C9H15NO2
MOLECULAR WEIGHT: 169.2209
SMILES: C1CC2CC1CCC2(C(=O)O)N
Structure:
CAS RN: 103298-51-7
CAS Name: (3S)-3-(4-amino-7-pyrrolo[2,3-d]pyrimidinyl)-2-nonanol
OPENEYE Name: (3S)-3-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)nonan-2-ol
IUPAC Name: (3S)-3-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)nonan-2-ol
SYSTEMATIC NAME: (3S)-3-(4-azanylpyrrolo[2,3-d]pyrimidin-7-yl)nonan-2-ol
MOLECULAR FORMULA: C15H24N4O
MOLECULAR WEIGHT: 276.37726
SMILES: CCCCCC[C@@H](C(C)O)N1C=CC2=C1N=CN=C2N
Structure:
CAS RN: 103294-47-9
CAS Name: 1-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole
OPENEYE Name: 1-tetralin-1-ylimidazole
IUPAC Name: 1-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole
SYSTEMATIC NAME: 1-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole
MOLECULAR FORMULA: C13H14N2
MOLECULAR WEIGHT: 198.26366
SMILES: C1CC(C2=CC=CC=C2C1)N3C=CN=C3
Structure:
CAS RN: 103090-53-5
CAS Name: (2R,3S,5R)-5-(7-amino-5-chloro-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-2-(hydroxymethyl)-3-oxolanol
OPENEYE Name: (2R,3S,5R)-5-(7-amino-5-chloro-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-2-(hydroxymethyl)tetrahydrofuran-3-ol
IUPAC Name: (2R,3S,5R)-5-(7-amino-5-chloro-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-2-(hydroxymethyl)oxolan-3-ol
SYSTEMATIC NAME: (2R,3S,5R)-5-(7-azanyl-5-chloranyl-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-2-(hydroxymethyl)oxolan-3-ol
MOLECULAR FORMULA: C10H12ClN5O3
MOLECULAR WEIGHT: 285.68698
SMILES: C1[C@@H]([C@H](O[C@H]1C2=C3C(=NN2)C(=NC(=N3)Cl)N)CO)O
Structure:
CAS RN: 103003-96-9
CAS Name: (2S)-2-[[[4-(1,3-diamino-5,6,6a,7,8,9-hexahydropyrimido[5,4-e]indolizin-8-yl)phenyl]-oxomethyl]amino]pentanedioic acid
OPENEYE Name: (2S)-2-[[4-(1,3-diamino-5,6,6a,7,8,9-hexahydropyrimido[5,4-e]indolizin-8-yl)benzoyl]amino]pentanedioic acid
IUPAC Name: (2S)-2-[[4-(1,3-diamino-5,6,6a,7,8,9-hexahydropyrimido[5,4-e]indolizin-8-yl)benzoyl]amino]pentanedioic acid
SYSTEMATIC NAME: (2S)-2-[[4-[1,3-bis(azanyl)-5,6,6a,7,8,9-hexahydropyrimido[5,4-e]indolizin-8-yl]phenyl]carbonylamino]pentanedioic acid
MOLECULAR FORMULA: C22H26N6O5
MOLECULAR WEIGHT: 454.47904
SMILES: C1CC2=C(C(=NC(=N2)N)N)N3C1CC(C3)C4=CC=C(C=C4)C(=O)N[C@@H](CCC(=O)O)C(=O)O
Structure:
CAS RN: 102993-90-8
CAS Name: 5-[bis(4-chlorophenyl)-(1-imidazolyl)methyl]pyrimidine
OPENEYE Name: 5-[bis(4-chlorophenyl)-imidazol-1-yl-methyl]pyrimidine
IUPAC Name: 5-[bis(4-chlorophenyl)-imidazol-1-ylmethyl]pyrimidine
SYSTEMATIC NAME: 5-[bis(4-chlorophenyl)-imidazol-1-yl-methyl]pyrimidine
MOLECULAR FORMULA: C20H14Cl2N4
MOLECULAR WEIGHT: 381.25796
SMILES: C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)(C3=CN=CN=C3)N4C=CN=C4)Cl
Structure:
CAS RN: 102941-25-3
CAS Name: N-[3-methoxy-4-[(1-methyl-9-acridinyl)amino]phenyl]methanesulfonamide
OPENEYE Name: N-[3-methoxy-4-[(1-methylacridin-9-yl)amino]phenyl]methanesulfonamide
IUPAC Name: N-[3-methoxy-4-[(1-methylacridin-9-yl)amino]phenyl]methanesulfonamide
SYSTEMATIC NAME: N-[3-methoxy-4-[(1-methylacridin-9-yl)amino]phenyl]methanesulfonamide
MOLECULAR FORMULA: C22H21N3O3S
MOLECULAR WEIGHT: 407.48544
SMILES: CC1=CC=CC2=NC3=CC=CC=C3C(=C12)NC4=C(C=C(C=C4)NS(=O)(=O)C)OC
Structure:
CAS RN: 54785-54-5
CAS Name: 2,3,8,9-tetramethoxy-5-methylbenzo[c]phenanthridin-5-ium chloride
OPENEYE Name: 2,3,8,9-tetramethoxy-5-methyl-benzo[c]phenanthridin-5-ium chloride
IUPAC Name: 2,3,8,9-tetramethoxy-5-methylbenzo[c]phenanthridin-5-ium chloride
SYSTEMATIC NAME: 2,3,8,9-tetramethoxy-5-methyl-benzo[c]phenanthridin-5-ium chloride
MOLECULAR FORMULA: C22H22ClNO4
MOLECULAR WEIGHT: 399.86738
SMILES: C[N+]1=CC2=CC(=C(C=C2C3=C1C4=CC(=C(C=C4C=C3)OC)OC)OC)OC.[Cl-]
Structure:
CAS RN: 102822-56-0
CAS Name: (1R,2R,3R,4S,5R)-4-amino-5-(methylthio)cyclopentane-1,2,3-triol
OPENEYE Name: (1R,2R,3R,4S,5R)-4-amino-5-methylsulfanyl-cyclopentane-1,2,3-triol
IUPAC Name: (1R,2R,3R,4S,5R)-4-amino-5-methylsulfanylcyclopentane-1,2,3-triol
SYSTEMATIC NAME: (1R,2R,3R,4S,5R)-4-azanyl-5-methylsulfanyl-cyclopentane-1,2,3-triol
MOLECULAR FORMULA: C6H13NO3S
MOLECULAR WEIGHT: 179.23732
SMILES: CS[C@@H]1[C@H]([C@H]([C@H]([C@H]1O)O)O)N
Structure:
CAS RN: 56358-17-9
CAS Name: [[3-[bis(phosphonomethyl)amino]-2-hydroxypropyl]-(phosphonomethyl)amino]methylphosphonic acid
OPENEYE Name: [[3-[bis(phosphonomethyl)amino]-2-hydroxy-propyl]-(phosphonomethyl)amino]methylphosphonic acid
IUPAC Name: [[3-[bis(phosphonomethyl)amino]-2-hydroxypropyl]-(phosphonomethyl)amino]methylphosphonic acid
SYSTEMATIC NAME: [[3-[bis(phosphonomethyl)amino]-2-oxidanyl-propyl]-(phosphonomethyl)amino]methylphosphonic acid
MOLECULAR FORMULA: C7H22N2O13P4
MOLECULAR WEIGHT: 466.150224
SMILES: C(C(CN(CP(=O)(O)O)CP(=O)(O)O)O)N(CP(=O)(O)O)CP(=O)(O)O
Structure:
CAS RN: 102791-33-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H7NO4
MOLECULAR WEIGHT: 265.22038
SMILES: C1=CC2=C3C(=C1)C(=O)OC4=C3C(=C(C=C4)[N+](=O)[O-])C=C2
Structure:
CAS RN: 102743-78-2
CAS Name: (2S)-2-[[[4-[[(2-amino-5-chloro-4-oxo-1H-quinazolin-6-yl)amino]methyl]phenyl]-oxomethyl]amino]pentanedioic acid
OPENEYE Name: (2S)-2-[[4-[[(2-amino-5-chloro-4-oxo-1H-quinazolin-6-yl)amino]methyl]benzoyl]amino]pentanedioic acid
IUPAC Name: (2S)-2-[[4-[[(2-amino-5-chloro-4-oxo-1H-quinazolin-6-yl)amino]methyl]benzoyl]amino]pentanedioic acid
SYSTEMATIC NAME: (2S)-2-[[4-[[(2-azanyl-5-chloranyl-4-oxidanylidene-1H-quinazolin-6-yl)amino]methyl]phenyl]carbonylamino]pentanedioic acid
MOLECULAR FORMULA: C21H20ClN5O6
MOLECULAR WEIGHT: 473.8664
SMILES: C1=CC(=CC=C1CNC2=C(C3=C(C=C2)NC(=NC3=O)N)Cl)C(=O)N[C@@H](CCC(=O)O)C(=O)O
Structure:
CAS RN: 102737-46-2
CAS Name: 2-[2-(hydroxyamino)-1-imidazolyl]-N-(2-hydroxyethyl)acetamide
OPENEYE Name: 2-[2-(hydroxyamino)imidazol-1-yl]-N-(2-hydroxyethyl)acetamide
IUPAC Name: 2-[2-(hydroxyamino)imidazol-1-yl]-N-(2-hydroxyethyl)acetamide
SYSTEMATIC NAME: N-(2-hydroxyethyl)-2-[2-(oxidanylamino)imidazol-1-yl]ethanamide
MOLECULAR FORMULA: C7H12N4O3
MOLECULAR WEIGHT: 200.19518
SMILES: C1=CN(C(=N1)NO)CC(=O)NCCO
Structure:
CAS RN: 102731-46-4
CAS Name: 7-[(2S,3R,4S,5S)-3,4-dihydroxy-5-(iodomethyl)-2-oxolanyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one
OPENEYE Name: 7-[(2S,3R,4S,5S)-3,4-dihydroxy-5-(iodomethyl)tetrahydrofuran-2-yl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one
IUPAC Name: 7-[(2S,3R,4S,5S)-3,4-dihydroxy-5-(iodomethyl)oxolan-2-yl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one
SYSTEMATIC NAME: 7-[(2S,3R,4S,5S)-5-(iodanylmethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one
MOLECULAR FORMULA: C11H12IN3O4
MOLECULAR WEIGHT: 377.13515
SMILES: C1=C(C2=C(N1)C(=O)N=CN2)[C@H]3[C@@H]([C@@H]([C@H](O3)CI)O)O
Structure:
CAS RN: 102651-47-8
CAS Name: (8R,9S,13S,14S,17S)-13-methyl-17-[(2R)-2-oxiranyl]-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
OPENEYE Name: (8R,9S,13S,14S,17S)-13-methyl-17-[(2R)-oxiran-2-yl]-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
IUPAC Name: (8R,9S,13S,14S,17S)-13-methyl-17-[(2R)-oxiran-2-yl]-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
SYSTEMATIC NAME: (8R,9S,13S,14S,17S)-13-methyl-17-[(2R)-oxiran-2-yl]-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
MOLECULAR FORMULA: C20H26O3
MOLECULAR WEIGHT: 314.41864
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2([C@H]4CO4)O)CCC5=C3C=CC(=C5)O
Structure:
CAS RN: 102650-30-6
CAS Name: 2-[2-[bis(carboxymethyl)amino]ethyl-[(2S)-2-[bis(carboxymethyl)amino]-3-(4-isothiocyanatophenyl)propyl]amino]acetic acid
OPENEYE Name: 2-[2-[bis(carboxymethyl)amino]ethyl-[(2S)-2-[bis(carboxymethyl)amino]-3-(4-isothiocyanatophenyl)propyl]amino]acetic acid
IUPAC Name: 2-[2-[bis(carboxymethyl)amino]ethyl-[(2S)-2-[bis(carboxymethyl)amino]-3-(4-isothiocyanatophenyl)propyl]amino]acetic acid
SYSTEMATIC NAME: 2-[2-[bis(2-hydroxy-2-oxoethyl)amino]ethyl-[(2S)-2-[bis(2-hydroxy-2-oxoethyl)amino]-3-(4-isothiocyanatophenyl)propyl]amino]ethanoic acid
MOLECULAR FORMULA: C22H28N4O10S
MOLECULAR WEIGHT: 540.54352
SMILES: C1=CC(=CC=C1C[C@@H](CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O)N=C=S
Structure:
CAS RN: 102649-78-5
CAS Name: 5-chloro-N-(6-phenylhexyl)-1-naphthalenesulfonamide
OPENEYE Name: 5-chloro-N-(6-phenylhexyl)naphthalene-1-sulfonamide
IUPAC Name: 5-chloro-N-(6-phenylhexyl)naphthalene-1-sulfonamide
SYSTEMATIC NAME: 5-chloranyl-N-(6-phenylhexyl)naphthalene-1-sulfonamide
MOLECULAR FORMULA: C22H24ClNO2S
MOLECULAR WEIGHT: 401.94946
SMILES: C1=CC=C(C=C1)CCCCCCNS(=O)(=O)C2=CC=CC3=C2C=CC=C3Cl
Structure:
CAS RN: 54482-00-7
CAS Name: [(2R,3S)-5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxy-2-oxolanyl]methyl dihydrogen phosphate; [(2R,3S,4R)-5-(4-amino-2-oxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methyl dihydrogen phosphate
OPENEYE Name: [(2R,3S)-5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate; [(2R,3S,4R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
IUPAC Name: [(2R,3S)-5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate; [(2R,3S,4R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
SYSTEMATIC NAME: [(2R,3S)-5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate; [(2R,3S,4R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate
MOLECULAR FORMULA: C19H28N8O15P2
MOLECULAR WEIGHT: 670.417742
SMILES: C1[C@@H]([C@H](OC1N2C=NC3=C2NC(=NC3=O)N)COP(=O)(O)O)O.C1=CN(C(=O)N=C1N)C2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O
Structure:
CAS RN: 54135-84-1
CAS Name: N-[4-[3-[[(2,3-dihydroxyphenyl)-oxomethyl]amino]propylamino]butyl]-2,3-dihydroxybenzamide
OPENEYE Name: N-[4-[3-[(2,3-dihydroxybenzoyl)amino]propylamino]butyl]-2,3-dihydroxy-benzamide
IUPAC Name: N-[4-[3-[(2,3-dihydroxybenzoyl)amino]propylamino]butyl]-2,3-dihydroxybenzamide
SYSTEMATIC NAME: N-[4-[3-[[2,3-bis(oxidanyl)phenyl]carbonylamino]propylamino]butyl]-2,3-bis(oxidanyl)benzamide
MOLECULAR FORMULA: C21H27N3O6
MOLECULAR WEIGHT: 417.45558
SMILES: C1=CC(=C(C(=C1)O)O)C(=O)NCCCCNCCCNC(=O)C2=C(C(=CC=C2)O)O
Structure:
CAS RN: 53914-15-1
CAS Name: (2R,3S,4R,5R)-3-[3-(dimethylamino)propoxy]-2,4,5,6-tetrahydroxyhexanal
OPENEYE Name: (2R,3S,4R,5R)-3-[3-(dimethylamino)propoxy]-2,4,5,6-tetrahydroxy-hexanal
IUPAC Name: (2R,3S,4R,5R)-3-[3-(dimethylamino)propoxy]-2,4,5,6-tetrahydroxyhexanal
SYSTEMATIC NAME: (2R,3S,4R,5R)-3-[3-(dimethylamino)propoxy]-2,4,5,6-tetrakis(oxidanyl)hexanal
MOLECULAR FORMULA: C11H23NO6
MOLECULAR WEIGHT: 265.30342
SMILES: CN(C)CCCO[C@H]([C@H](C=O)O)[C@@H]([C@@H](CO)O)O
Structure:
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