CAS RN: 62917-82-2
CAS Name: 2-hydroxy-2-(2,4,5-trihydroxyphenyl)indene-1,3-dione
OPENEYE Name: 2-hydroxy-2-(2,4,5-trihydroxyphenyl)indane-1,3-dione
IUPAC Name: 2-hydroxy-2-(2,4,5-trihydroxyphenyl)indene-1,3-dione
SYSTEMATIC NAME: 2-oxidanyl-2-[2,4,5-tris(oxidanyl)phenyl]indene-1,3-dione
MOLECULAR FORMULA: C15H10O6
MOLECULAR WEIGHT: 286.2363
SMILES: C1=CC=C2C(=C1)C(=O)C(C2=O)(C3=CC(=C(C=C3O)O)O)O
Structure:
CAS RN: 62917-81-1
CAS Name: 2-(2,3-dihydroxyphenyl)-2-hydroxyindene-1,3-dione
OPENEYE Name: 2-(2,3-dihydroxyphenyl)-2-hydroxy-indane-1,3-dione
IUPAC Name: 2-(2,3-dihydroxyphenyl)-2-hydroxyindene-1,3-dione
SYSTEMATIC NAME: 2-[2,3-bis(oxidanyl)phenyl]-2-oxidanyl-indene-1,3-dione
MOLECULAR FORMULA: C15H10O5
MOLECULAR WEIGHT: 270.2369
SMILES: C1=CC=C2C(=C1)C(=O)C(C2=O)(C3=C(C(=CC=C3)O)O)O
Structure:
CAS RN: 62913-16-0
CAS Name: 2-hydroxy-2-(1-methoxyethyl)-3-methylbutanoic acid [7-hydroxy-4-[10-[1-hydroxy-7-[[2-hydroxy-2-(1-methoxyethyl)-3-methyl-1-oxobutoxy]methyl]-2,3,5,8-tetrahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl ester dibrom
OPENEYE Name: [7-hydroxy-4-[10-[1-hydroxy-7-[(2-hydroxy-2-isopropyl-3-methoxy-butanoyl)oxymethyl]-2,3,5,8-tetrahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl 2-hydroxy-2-isopropyl-3-methoxy-butanoate dibromide
IUPAC Name: [7-hydroxy-4-[10-[1-hydroxy-7-[[2-hydroxy-2-(1-methoxyethyl)-3-methylbutanoyl]oxymethyl]-2,3,5,8-tetrahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl 2-hydroxy-2-(1-methoxyethyl)-3-methylbutanoate dibromide
SYSTEMATIC NAME: [4-[10-[7-[[2-(1-methoxyethyl)-3-methyl-2-oxidanyl-butanoyl]oxymethyl]-1-oxidanyl-2,3,5,8-tetrahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-7-oxidanyl-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl 2-(1-methoxyethyl)-3-methyl-2-oxidanyl-butanoate dibromide
MOLECULAR FORMULA: C42H74Br2N2O10
MOLECULAR WEIGHT: 926.85236
SMILES: CC(C)C(C(C)OC)(C(=O)OCC1=CC[N+]2(C1C(CC2)O)CCCCCCCCCC[N+]34CCC(C3C(=CC4)COC(=O)C(C(C)C)(C(C)OC)O)O)O.[Br-].[Br-]
Structure:
CAS RN: 62913-13-7
CAS Name: 3-methyl-2-butenoic acid [(1R,8R)-4-[10-[(1R,8R)-1-[(3-methyl-1-oxobut-2-enoxy)methyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl ester dibromide
OPENEYE Name: [(1R,8R)-4-[10-[(1R,8R)-1-(3-methylbut-2-enoyloxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 3-methylbut-2-enoate dibromide
IUPAC Name: [(1R,8R)-4-[10-[(1R,8R)-1-(3-methylbut-2-enoyloxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 3-methylbut-2-enoate dibromide
SYSTEMATIC NAME: [(1R,8R)-4-[10-[(1R,8R)-1-(3-methylbut-2-enoyloxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 3-methylbut-2-enoate dibromide
MOLECULAR FORMULA: C36H62Br2N2O4
MOLECULAR WEIGHT: 746.69648
SMILES: CC(=CC(=O)OC[C@@H]1CC[N+]2([C@@H]1CCC2)CCCCCCCCCC[N+]34CCC[C@@H]3[C@@H](CC4)COC(=O)C=C(C)C)C.[Br-].[Br-]
Structure:
CAS RN: 62913-12-6
CAS Name: 3-methyl-2-butenoic acid [(1R,8R)-4-[9-[(1R,8R)-1-[(3-methyl-1-oxobut-2-enoxy)methyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]nonyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl ester dibromide
OPENEYE Name: [(1R,8R)-4-[9-[(1R,8R)-1-(3-methylbut-2-enoyloxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]nonyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 3-methylbut-2-enoate dibromide
IUPAC Name: [(1R,8R)-4-[9-[(1R,8R)-1-(3-methylbut-2-enoyloxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]nonyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 3-methylbut-2-enoate dibromide
SYSTEMATIC NAME: [(1R,8R)-4-[9-[(1R,8R)-1-(3-methylbut-2-enoyloxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]nonyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 3-methylbut-2-enoate dibromide
MOLECULAR FORMULA: C35H60Br2N2O4
MOLECULAR WEIGHT: 732.6699
SMILES: CC(=CC(=O)OC[C@@H]1CC[N+]2([C@@H]1CCC2)CCCCCCCCC[N+]34CCC[C@@H]3[C@@H](CC4)COC(=O)C=C(C)C)C.[Br-].[Br-]
Structure:
CAS RN: 62913-11-5
CAS Name: 3-methyl-2-butenoic acid [(1R,8R)-4-[8-[(1R,8R)-1-[(3-methyl-1-oxobut-2-enoxy)methyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]octyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl ester dibromide
OPENEYE Name: [(1R,8R)-4-[8-[(1R,8R)-1-(3-methylbut-2-enoyloxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]octyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 3-methylbut-2-enoate dibromide
IUPAC Name: [(1R,8R)-4-[8-[(1R,8R)-1-(3-methylbut-2-enoyloxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]octyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 3-methylbut-2-enoate dibromide
SYSTEMATIC NAME: [(1R,8R)-4-[8-[(1R,8R)-1-(3-methylbut-2-enoyloxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]octyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 3-methylbut-2-enoate dibromide
MOLECULAR FORMULA: C34H58Br2N2O4
MOLECULAR WEIGHT: 718.64332
SMILES: CC(=CC(=O)OC[C@@H]1CC[N+]2([C@@H]1CCC2)CCCCCCCC[N+]34CCC[C@@H]3[C@@H](CC4)COC(=O)C=C(C)C)C.[Br-].[Br-]
Structure:
CAS RN: 62913-10-4
CAS Name: 3-methylbutanoic acid [(1R,8R)-4-[10-[(1R,8R)-1-[(3-methyl-1-oxobutoxy)methyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl ester dibromide
OPENEYE Name: [(1R,8R)-4-[10-[(1R,8R)-1-(3-methylbutanoyloxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 3-methylbutanoate dibromide
IUPAC Name: [(1R,8R)-4-[10-[(1R,8R)-1-(3-methylbutanoyloxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 3-methylbutanoate dibromide
SYSTEMATIC NAME: [(1R,8R)-4-[10-[(1R,8R)-1-(3-methylbutanoyloxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 3-methylbutanoate dibromide
MOLECULAR FORMULA: C36H66Br2N2O4
MOLECULAR WEIGHT: 750.72824
SMILES: CC(C)CC(=O)OC[C@@H]1CC[N+]2([C@@H]1CCC2)CCCCCCCCCC[N+]34CCC[C@@H]3[C@@H](CC4)COC(=O)CC(C)C.[Br-].[Br-]
Structure:
CAS RN: 62913-09-1
CAS Name: benzoic acid [(1R,8R)-4-[10-[(1R,8R)-1-(benzoyloxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl ester dibromide
OPENEYE Name: [(1R,8R)-4-[10-[(1R,8R)-1-(benzoyloxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl benzoate dibromide
IUPAC Name: [(1R,8R)-4-[10-[(1R,8R)-1-(benzoyloxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl benzoate dibromide
SYSTEMATIC NAME: [(1R,8R)-4-[10-[(1R,8R)-1-(phenylcarbonyloxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]decyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl benzoate dibromide
MOLECULAR FORMULA: C40H58Br2N2O4
MOLECULAR WEIGHT: 790.70752
SMILES: C1C[C@@H]2[C@@H](CC[N+]2(C1)CCCCCCCCCC[N+]34CCC[C@@H]3[C@@H](CC4)COC(=O)C5=CC=CC=C5)COC(=O)C6=CC=CC=C6.[Br-].[Br-]
Structure:
CAS RN: 62913-08-0
CAS Name: [(1R,8R)-4-[9-[(1R,8R)-1-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]nonyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methanol dibromide
OPENEYE Name: [(1R,8R)-4-[9-[(1R,8R)-1-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]nonyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methanol dibromide
IUPAC Name: [(1R,8R)-4-[9-[(1R,8R)-1-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]nonyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methanol dibromide
SYSTEMATIC NAME: [(1R,8R)-4-[9-[(1R,8R)-1-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]nonyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methanol dibromide
MOLECULAR FORMULA: C25H48Br2N2O2
MOLECULAR WEIGHT: 568.46882
SMILES: C1C[C@@H]2[C@@H](CC[N+]2(C1)CCCCCCCCC[N+]34CCC[C@@H]3[C@@H](CC4)CO)CO.[Br-].[Br-]
Structure:
CAS RN: 62913-07-9
CAS Name: [(1R,8R)-4-[8-[(1R,8R)-1-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]octyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methanol dibromide
OPENEYE Name: [(1R,8R)-4-[8-[(1R,8R)-1-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]octyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methanol dibromide
IUPAC Name: [(1R,8R)-4-[8-[(1R,8R)-1-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]octyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methanol dibromide
SYSTEMATIC NAME: [(1R,8R)-4-[8-[(1R,8R)-1-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]octyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methanol dibromide
MOLECULAR FORMULA: C24H46Br2N2O2
MOLECULAR WEIGHT: 554.44224
SMILES: C1C[C@@H]2[C@@H](CC[N+]2(C1)CCCCCCCC[N+]34CCC[C@@H]3[C@@H](CC4)CO)CO.[Br-].[Br-]
Structure:
CAS RN: 62913-06-8
CAS Name: 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoic acid [4-[8-[1-[[2-hydroxy-2-(1-hydroxyethyl)-3-methyl-1-oxobutoxy]methyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]octyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl ester dibromide
OPENEYE Name: [4-[8-[1-[[2-hydroxy-2-(1-hydroxyethyl)-3-methyl-butanoyl]oxymethyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]octyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methyl-butanoate dibromide
IUPAC Name: [4-[8-[1-[[2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoyl]oxymethyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]octyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoate dibromide
SYSTEMATIC NAME: [4-[8-[1-[[2-(1-hydroxyethyl)-3-methyl-2-oxidanyl-butanoyl]oxymethyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]octyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 2-(1-hydroxyethyl)-3-methyl-2-oxidanyl-butanoate dibromide
MOLECULAR FORMULA: C38H70Br2N2O8
MOLECULAR WEIGHT: 842.779
SMILES: CC(C)C(C(C)O)(C(=O)OCC1CC[N+]2(C1CCC2)CCCCCCCC[N+]34CCCC3C(CC4)COC(=O)C(C(C)C)(C(C)O)O)O.[Br-].[Br-]
Structure:
CAS RN: 62989-84-8
CAS Name: 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoic acid [4-[8-[1-[[2-hydroxy-2-(1-hydroxyethyl)-3-methyl-1-oxobutoxy]methyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]octyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl ester dibromide
OPENEYE Name: [4-[8-[1-[[2-hydroxy-2-(1-hydroxyethyl)-3-methyl-butanoyl]oxymethyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]octyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methyl-butanoate dibromide
IUPAC Name: [4-[8-[1-[[2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoyl]oxymethyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]octyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoate dibromide
SYSTEMATIC NAME: [4-[8-[1-[[2-(1-hydroxyethyl)-3-methyl-2-oxidanyl-butanoyl]oxymethyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]octyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 2-(1-hydroxyethyl)-3-methyl-2-oxidanyl-butanoate dibromide
MOLECULAR FORMULA: C38H70Br2N2O8
MOLECULAR WEIGHT: 842.779
SMILES: CC(C)C(C(C)O)(C(=O)OCC1CC[N+]2(C1CCC2)CCCCCCCC[N+]34CCCC3C(CC4)COC(=O)C(C(C)C)(C(C)O)O)O.[Br-].[Br-]
Structure:
CAS RN: 62913-05-7
CAS Name: 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoic acid [4-[9-[1-[[2-hydroxy-2-(1-hydroxyethyl)-3-methyl-1-oxobutoxy]methyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]nonyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl ester dibromide
OPENEYE Name: [4-[9-[1-[[2-hydroxy-2-(1-hydroxyethyl)-3-methyl-butanoyl]oxymethyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]nonyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methyl-butanoate dibromide
IUPAC Name: [4-[9-[1-[[2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoyl]oxymethyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]nonyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoate dibromide
SYSTEMATIC NAME: [4-[9-[1-[[2-(1-hydroxyethyl)-3-methyl-2-oxidanyl-butanoyl]oxymethyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]nonyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 2-(1-hydroxyethyl)-3-methyl-2-oxidanyl-butanoate dibromide
MOLECULAR FORMULA: C39H72Br2N2O8
MOLECULAR WEIGHT: 856.80558
SMILES: CC(C)C(C(C)O)(C(=O)OCC1CC[N+]2(C1CCC2)CCCCCCCCC[N+]34CCCC3C(CC4)COC(=O)C(C(C)C)(C(C)O)O)O.[Br-].[Br-]
Structure:
CAS RN: 62960-84-3
CAS Name: 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoic acid [4-[9-[1-[[2-hydroxy-2-(1-hydroxyethyl)-3-methyl-1-oxobutoxy]methyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]nonyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl ester dibromide
OPENEYE Name: [4-[9-[1-[[2-hydroxy-2-(1-hydroxyethyl)-3-methyl-butanoyl]oxymethyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]nonyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methyl-butanoate dibromide
IUPAC Name: [4-[9-[1-[[2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoyl]oxymethyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]nonyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoate dibromide
SYSTEMATIC NAME: [4-[9-[1-[[2-(1-hydroxyethyl)-3-methyl-2-oxidanyl-butanoyl]oxymethyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-4-yl]nonyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 2-(1-hydroxyethyl)-3-methyl-2-oxidanyl-butanoate dibromide
MOLECULAR FORMULA: C39H72Br2N2O8
MOLECULAR WEIGHT: 856.80558
SMILES: CC(C)C(C(C)O)(C(=O)OCC1CC[N+]2(C1CCC2)CCCCCCCCC[N+]34CCCC3C(CC4)COC(=O)C(C(C)C)(C(C)O)O)O.[Br-].[Br-]
Structure:
CAS RN: 62912-50-9
CAS Name: 2-[2-[2-[2-(diethylamino)ethoxy]ethoxy]ethoxy]-N,N-diethylethanamine
OPENEYE Name: 2-[2-[2-[2-(diethylamino)ethoxy]ethoxy]ethoxy]-N,N-diethyl-ethanamine
IUPAC Name: 2-[2-[2-[2-(diethylamino)ethoxy]ethoxy]ethoxy]-N,N-diethylethanamine
SYSTEMATIC NAME: 2-[2-[2-[2-(diethylamino)ethoxy]ethoxy]ethoxy]-N,N-diethyl-ethanamine
MOLECULAR FORMULA: C16H36N2O3
MOLECULAR WEIGHT: 304.46864
SMILES: CCN(CC)CCOCCOCCOCCN(CC)CC
Structure:
CAS RN: 62912-25-8
CAS Name: N'-cyclohexyl-3-[2-(cyclohexylhydrazo)-2-oxoethyl]-2,2-dimethyl-1-cyclobutanecarbohydrazide
OPENEYE Name: N'-cyclohexyl-3-[2-(2-cyclohexylhydrazino)-2-oxo-ethyl]-2,2-dimethyl-cyclobutanecarbohydrazide
IUPAC Name: N'-cyclohexyl-3-[2-(2-cyclohexylhydrazinyl)-2-oxoethyl]-2,2-dimethylcyclobutane-1-carbohydrazide
SYSTEMATIC NAME: N'-cyclohexyl-3-[2-(2-cyclohexylhydrazinyl)-2-oxidanylidene-ethyl]-2,2-dimethyl-cyclobutane-1-carbohydrazide
MOLECULAR FORMULA: C21H38N4O2
MOLECULAR WEIGHT: 378.55202
SMILES: CC1(C(CC1C(=O)NNC2CCCCC2)CC(=O)NNC3CCCCC3)C
Structure:
CAS RN: 62911-27-7
CAS Name: 2-[[dimethylamino(sulfanylidene)methyl]disulfanyl]benzoic acid
OPENEYE Name: 2-(dimethylcarbamothioyldisulfanyl)benzoic acid
IUPAC Name: 2-(dimethylcarbamothioyldisulfanyl)benzoic acid
SYSTEMATIC NAME: 2-(dimethylcarbamothioyldisulfanyl)benzoic acid
MOLECULAR FORMULA: C10H11NO2S3
MOLECULAR WEIGHT: 273.39484
SMILES: CN(C)C(=S)SSC1=CC=CC=C1C(=O)O
Structure:
CAS RN: 62911-20-0
CAS Name: 4-decyl-1,2,4-dithiazinane-3-thione
OPENEYE Name: 4-decyl-1,2,4-dithiazinane-3-thione
IUPAC Name: 4-decyl-1,2,4-dithiazinane-3-thione
SYSTEMATIC NAME: 4-decyl-1,2,4-dithiazinane-3-thione
MOLECULAR FORMULA: C13H25NS3
MOLECULAR WEIGHT: 291.5393
SMILES: CCCCCCCCCCN1CCSSC1=S
Structure:
CAS RN: 62906-55-2
CAS Name: 2-[4-[3-[(1,4-diphenyl-3-pyrazolyl)oxy]propyl]-1-piperazinyl]ethanol; methanesulfonic acid
OPENEYE Name: 2-[4-[3-(1,4-diphenylpyrazol-3-yl)oxypropyl]piperazin-1-yl]ethanol; methanesulfonic acid
IUPAC Name: 2-[4-[3-(1,4-diphenylpyrazol-3-yl)oxypropyl]piperazin-1-yl]ethanol; methanesulfonic acid
SYSTEMATIC NAME: 2-[4-[3-(1,4-diphenylpyrazol-3-yl)oxypropyl]piperazin-1-yl]ethanol; methanesulfonic acid
MOLECULAR FORMULA: C26H38N4O8S2
MOLECULAR WEIGHT: 598.73192
SMILES: CS(=O)(=O)O.CS(=O)(=O)O.C1CN(CCN1CCCOC2=NN(C=C2C3=CC=CC=C3)C4=CC=CC=C4)CCO
Structure:
CAS RN: 62906-54-1
CAS Name: 4-[2-[[4-(4-chlorophenyl)-1-phenyl-3-pyrazolyl]oxy]ethyl]morpholine; methanesulfonic acid
OPENEYE Name: 4-[2-[4-(4-chlorophenyl)-1-phenyl-pyrazol-3-yl]oxyethyl]morpholine; methanesulfonic acid
IUPAC Name: 4-[2-[4-(4-chlorophenyl)-1-phenylpyrazol-3-yl]oxyethyl]morpholine; methanesulfonic acid
SYSTEMATIC NAME: 4-[2-[4-(4-chlorophenyl)-1-phenyl-pyrazol-3-yl]oxyethyl]morpholine; methanesulfonic acid
MOLECULAR FORMULA: C22H26ClN3O5S
MOLECULAR WEIGHT: 479.97694
SMILES: CS(=O)(=O)O.C1COCCN1CCOC2=NN(C=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4
Structure:
CAS RN: 62905-79-7
CAS Name: 4-amino-1-cyclohexanol; platinum(2+); dichloride
OPENEYE Name: 4-aminocyclohexanol; platinum(2+); dichloride
IUPAC Name: 4-aminocyclohexan-1-ol; platinum(2+); dichloride
SYSTEMATIC NAME: 4-azanylcyclohexan-1-ol; platinum(2+); dichloride
MOLECULAR FORMULA: C12H26Cl2N2O2Pt
MOLECULAR WEIGHT: 496.33104
SMILES: C1CC(CCC1N)O.C1CC(CCC1N)O.[Cl-].[Cl-].[Pt+2]
Structure:
CAS RN: 62897-94-3
CAS Name: 1-ethoxy-4-[2-nitro-1-(4-propoxyphenyl)propyl]benzene
OPENEYE Name: 1-ethoxy-4-[2-nitro-1-(4-propoxyphenyl)propyl]benzene
IUPAC Name: 1-ethoxy-4-[2-nitro-1-(4-propoxyphenyl)propyl]benzene
SYSTEMATIC NAME: 1-ethoxy-4-[2-nitro-1-(4-propoxyphenyl)propyl]benzene
MOLECULAR FORMULA: C20H25NO4
MOLECULAR WEIGHT: 343.4168
SMILES: CCCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC)C(C)[N+](=O)[O-]
Structure:
CAS RN: 62897-76-1
CAS Name: 1-[2,2-dimethyl-1-(4-propoxyphenyl)propyl]-4-ethoxybenzene
OPENEYE Name: 1-[2,2-dimethyl-1-(4-propoxyphenyl)propyl]-4-ethoxy-benzene
IUPAC Name: 1-[2,2-dimethyl-1-(4-propoxyphenyl)propyl]-4-ethoxybenzene
SYSTEMATIC NAME: 1-[2,2-dimethyl-1-(4-propoxyphenyl)propyl]-4-ethoxy-benzene
MOLECULAR FORMULA: C22H30O2
MOLECULAR WEIGHT: 326.4724
SMILES: CCCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC)C(C)(C)C
Structure:
CAS RN: 62897-69-2
CAS Name: 1-[2,2-dichloro-1-(4-ethoxyphenyl)propyl]-4-propoxybenzene
OPENEYE Name: 1-[2,2-dichloro-1-(4-ethoxyphenyl)propyl]-4-propoxy-benzene
IUPAC Name: 1-[2,2-dichloro-1-(4-ethoxyphenyl)propyl]-4-propoxybenzene
SYSTEMATIC NAME: 1-[2,2-bis(chloranyl)-1-(4-ethoxyphenyl)propyl]-4-propoxy-benzene
MOLECULAR FORMULA: C20H24Cl2O2
MOLECULAR WEIGHT: 367.30936
SMILES: CCCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC)C(C)(Cl)Cl
Structure:
CAS RN: 62897-64-7
CAS Name: 1-[2,2-dichloro-1-(4-ethoxyphenyl)ethyl]-4-propoxybenzene
OPENEYE Name: 1-[2,2-dichloro-1-(4-ethoxyphenyl)ethyl]-4-propoxy-benzene
IUPAC Name: 1-[2,2-dichloro-1-(4-ethoxyphenyl)ethyl]-4-propoxybenzene
SYSTEMATIC NAME: 1-[2,2-bis(chloranyl)-1-(4-ethoxyphenyl)ethyl]-4-propoxy-benzene
MOLECULAR FORMULA: C19H22Cl2O2
MOLECULAR WEIGHT: 353.28278
SMILES: CCCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC)C(Cl)Cl
Structure:
CAS RN: 62893-48-5
CAS Name: 2-[(dimethylamino)methyl]-1-phenyl-1-cyclohexanol
OPENEYE Name: 2-[(dimethylamino)methyl]-1-phenyl-cyclohexanol
IUPAC Name: 2-[(dimethylamino)methyl]-1-phenylcyclohexan-1-ol
SYSTEMATIC NAME: 2-[(dimethylamino)methyl]-1-phenyl-cyclohexan-1-ol
MOLECULAR FORMULA: C15H23NO
MOLECULAR WEIGHT: 233.34922
SMILES: CN(C)CC1CCCCC1(C2=CC=CC=C2)O
Structure:
CAS RN: 62888-75-9
CAS Name: N,N-dimethyl-2-[[2-methyl-4-[4-(trifluoromethyl)phenyl]-3,4-dihydro-1H-isoquinolin-7-yl]oxy]ethanamine
OPENEYE Name: N,N-dimethyl-2-[[2-methyl-4-[4-(trifluoromethyl)phenyl]-3,4-dihydro-1H-isoquinolin-7-yl]oxy]ethanamine
IUPAC Name: N,N-dimethyl-2-[[2-methyl-4-[4-(trifluoromethyl)phenyl]-3,4-dihydro-1H-isoquinolin-7-yl]oxy]ethanamine
SYSTEMATIC NAME: N,N-dimethyl-2-[[2-methyl-4-[4-(trifluoromethyl)phenyl]-3,4-dihydro-1H-isoquinolin-7-yl]oxy]ethanamine
MOLECULAR FORMULA: C21H25F3N2O
MOLECULAR WEIGHT: 378.43121
SMILES: CN1CC(C2=C(C1)C=C(C=C2)OCCN(C)C)C3=CC=C(C=C3)C(F)(F)F
Structure:
CAS RN: 62881-18-9
CAS Name: 2-[[1,4-bis(4-chlorophenyl)-3-pyrazolyl]oxy]-N,N-dimethylethanamine; methanesulfonic acid
OPENEYE Name: 2-[1,4-bis(4-chlorophenyl)pyrazol-3-yl]oxy-N,N-dimethyl-ethanamine; methanesulfonic acid
IUPAC Name: 2-[1,4-bis(4-chlorophenyl)pyrazol-3-yl]oxy-N,N-dimethylethanamine; methanesulfonic acid
SYSTEMATIC NAME: 2-[1,4-bis(4-chlorophenyl)pyrazol-3-yl]oxy-N,N-dimethyl-ethanamine; methanesulfonic acid
MOLECULAR FORMULA: C20H23Cl2N3O4S
MOLECULAR WEIGHT: 472.38532
SMILES: CN(C)CCOC1=NN(C=C1C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl.CS(=O)(=O)O
Structure:
CAS RN: 62874-94-6
CAS Name: 6-acetyl-5-hydroxy-4-methoxy-7,8-dihydro-3H-pyrrolo[3,2-e]indole-2-carboxylic acid
OPENEYE Name: 6-acetyl-5-hydroxy-4-methoxy-7,8-dihydro-3H-pyrrolo[3,2-e]indole-2-carboxylic acid
IUPAC Name: 6-acetyl-5-hydroxy-4-methoxy-7,8-dihydro-3H-pyrrolo[3,2-e]indole-2-carboxylic acid
SYSTEMATIC NAME: 6-ethanoyl-4-methoxy-5-oxidanyl-7,8-dihydro-3H-pyrrolo[3,2-e]indole-2-carboxylic acid
MOLECULAR FORMULA: C14H14N2O5
MOLECULAR WEIGHT: 290.27136
SMILES: CC(=O)N1CCC2=C3C=C(NC3=C(C(=C21)O)OC)C(=O)O
Structure:
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