CAS RN: 54108-07-5
CAS Name: benzenesulfonic acid (1,3-dioxo-2-pyrrolo[3,4-b]quinoxalinyl) ester
OPENEYE Name: (1,3-dioxopyrrolo[3,4-b]quinoxalin-2-yl) benzenesulfonate
IUPAC Name: (1,3-dioxopyrrolo[3,4-b]quinoxalin-2-yl) benzenesulfonate
SYSTEMATIC NAME: [1,3-bis(oxidanylidene)pyrrolo[3,4-b]quinoxalin-2-yl] benzenesulfonate
MOLECULAR FORMULA: C16H9N3O5S
MOLECULAR WEIGHT: 355.32476
SMILES: C1=CC=C(C=C1)S(=O)(=O)ON2C(=O)C3=NC4=CC=CC=C4N=C3C2=O
Structure:
CAS RN: 54108-05-3
CAS Name: 2-hydroxypyrrolo[3,4-b]quinoxaline-1,3-dione
OPENEYE Name: 2-hydroxypyrrolo[3,4-b]quinoxaline-1,3-dione
IUPAC Name: 2-hydroxypyrrolo[3,4-b]quinoxaline-1,3-dione
SYSTEMATIC NAME: 2-oxidanylpyrrolo[3,4-b]quinoxaline-1,3-dione
MOLECULAR FORMULA: C10H5N3O3
MOLECULAR WEIGHT: 215.165
SMILES: C1=CC=C2C(=C1)N=C3C(=N2)C(=O)N(C3=O)O
Structure:
CAS RN: 53229-51-9
CAS Name: 3-hydroxy-1H-thieno[3,2-d]pyrimidine-2,4-dione
OPENEYE Name: 3-hydroxy-1H-thieno[3,2-d]pyrimidine-2,4-dione
IUPAC Name: 3-hydroxy-1H-thieno[3,2-d]pyrimidine-2,4-dione
SYSTEMATIC NAME: 3-oxidanyl-1H-thieno[3,2-d]pyrimidine-2,4-dione
MOLECULAR FORMULA: C6H4N2O3S
MOLECULAR WEIGHT: 184.17256
SMILES: C1=CSC2=C1NC(=O)N(C2=O)O
Structure:
CAS RN: 53229-50-8
CAS Name: benzenesulfonic acid (2,4-dioxo-1H-thieno[3,2-d]pyrimidin-3-yl) ester
OPENEYE Name: (2,4-dioxo-1H-thieno[3,2-d]pyrimidin-3-yl) benzenesulfonate
IUPAC Name: (2,4-dioxo-1H-thieno[3,2-d]pyrimidin-3-yl) benzenesulfonate
SYSTEMATIC NAME: [2,4-bis(oxidanylidene)-1H-thieno[3,2-d]pyrimidin-3-yl] benzenesulfonate
MOLECULAR FORMULA: C12H8N2O5S2
MOLECULAR WEIGHT: 324.33232
SMILES: C1=CC=C(C=C1)S(=O)(=O)ON2C(=O)C3=C(C=CS3)NC2=O
Structure:
CAS RN: 53229-49-5
CAS Name: 3-hydroxy-1H-thieno[2,3-d]pyrimidine-2,4-dione
OPENEYE Name: 3-hydroxy-1H-thieno[2,3-d]pyrimidine-2,4-dione
IUPAC Name: 3-hydroxy-1H-thieno[2,3-d]pyrimidine-2,4-dione
SYSTEMATIC NAME: 3-oxidanyl-1H-thieno[2,3-d]pyrimidine-2,4-dione
MOLECULAR FORMULA: C6H4N2O3S
MOLECULAR WEIGHT: 184.17256
SMILES: C1=CSC2=C1C(=O)N(C(=O)N2)O
Structure:
CAS RN: 53229-48-4
CAS Name: benzenesulfonic acid (2,4-dioxo-1H-thieno[2,3-d]pyrimidin-3-yl) ester
OPENEYE Name: (2,4-dioxo-1H-thieno[2,3-d]pyrimidin-3-yl) benzenesulfonate
IUPAC Name: (2,4-dioxo-1H-thieno[2,3-d]pyrimidin-3-yl) benzenesulfonate
SYSTEMATIC NAME: [2,4-bis(oxidanylidene)-1H-thieno[2,3-d]pyrimidin-3-yl] benzenesulfonate
MOLECULAR FORMULA: C12H8N2O5S2
MOLECULAR WEIGHT: 324.33232
SMILES: C1=CC=C(C=C1)S(=O)(=O)ON2C(=O)C3=C(NC2=O)SC=C3
Structure:
CAS RN: 53229-53-1
CAS Name: 3-hydroxy-1H-thieno[3,4-d]pyrimidine-2,4-dione
OPENEYE Name: 3-hydroxy-1H-thieno[3,4-d]pyrimidine-2,4-dione
IUPAC Name: 3-hydroxy-1H-thieno[3,4-d]pyrimidine-2,4-dione
SYSTEMATIC NAME: 3-oxidanyl-1H-thieno[3,4-d]pyrimidine-2,4-dione
MOLECULAR FORMULA: C6H4N2O3S
MOLECULAR WEIGHT: 184.17256
SMILES: C1=C2C(=CS1)NC(=O)N(C2=O)O
Structure:
CAS RN: 53229-52-0
CAS Name: benzenesulfonic acid (2,4-dioxo-1H-thieno[3,4-d]pyrimidin-3-yl) ester
OPENEYE Name: (2,4-dioxo-1H-thieno[3,4-d]pyrimidin-3-yl) benzenesulfonate
IUPAC Name: (2,4-dioxo-1H-thieno[3,4-d]pyrimidin-3-yl) benzenesulfonate
SYSTEMATIC NAME: [2,4-bis(oxidanylidene)-1H-thieno[3,4-d]pyrimidin-3-yl] benzenesulfonate
MOLECULAR FORMULA: C12H8N2O5S2
MOLECULAR WEIGHT: 324.33232
SMILES: C1=CC=C(C=C1)S(=O)(=O)ON2C(=O)C3=CSC=C3NC2=O
Structure:
CAS RN: 40899-71-6
CAS Name: 1-(benzenesulfonyl)indole
OPENEYE Name: 1-(benzenesulfonyl)indole
IUPAC Name: 1-(benzenesulfonyl)indole
SYSTEMATIC NAME: 1-(phenylsulfonyl)indole
MOLECULAR FORMULA: C14H11NO2S
MOLECULAR WEIGHT: 257.30764
SMILES: C1=CC=C(C=C1)S(=O)(=O)N2C=CC3=CC=CC=C32
Structure:
CAS RN: 40899-91-0
CAS Name: [1-(benzenesulfonyl)-2-indolyl]-(3-pyridinyl)methanone
OPENEYE Name: [1-(benzenesulfonyl)indol-2-yl]-(3-pyridyl)methanone
IUPAC Name: [1-(benzenesulfonyl)indol-2-yl]-pyridin-3-ylmethanone
SYSTEMATIC NAME: [1-(phenylsulfonyl)indol-2-yl]-pyridin-3-yl-methanone
MOLECULAR FORMULA: C20H14N2O3S
MOLECULAR WEIGHT: 362.40176
SMILES: C1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C=C2C(=O)C4=CN=CC=C4
Structure:
CAS RN: 54851-97-7
CAS Name: 1-[4-[[1-(benzenesulfonyl)-2-indolyl]-hydroxymethyl]-1-piperidinyl]-2-chloroethanone
OPENEYE Name: 1-[4-[[1-(benzenesulfonyl)indol-2-yl]-hydroxy-methyl]-1-piperidyl]-2-chloro-ethanone
IUPAC Name: 1-[4-[[1-(benzenesulfonyl)indol-2-yl]-hydroxymethyl]piperidin-1-yl]-2-chloroethanone
SYSTEMATIC NAME: 2-chloranyl-1-[4-[oxidanyl-[1-(phenylsulfonyl)indol-2-yl]methyl]piperidin-1-yl]ethanone
MOLECULAR FORMULA: C22H23ClN2O4S
MOLECULAR WEIGHT: 446.94702
SMILES: C1CN(CCC1C(C2=CC3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4)O)C(=O)CCl
Structure:
CAS RN: 54852-17-4
CAS Name: 2-chloro-1-[4-[[2-(1H-indol-2-yl)-1,3-dioxolan-2-yl]methyl]-1-piperidinyl]ethanone
OPENEYE Name: 2-chloro-1-[4-[[2-(1H-indol-2-yl)-1,3-dioxolan-2-yl]methyl]-1-piperidyl]ethanone
IUPAC Name: 2-chloro-1-[4-[[2-(1H-indol-2-yl)-1,3-dioxolan-2-yl]methyl]piperidin-1-yl]ethanone
SYSTEMATIC NAME: 2-chloranyl-1-[4-[[2-(1H-indol-2-yl)-1,3-dioxolan-2-yl]methyl]piperidin-1-yl]ethanone
MOLECULAR FORMULA: C19H23ClN2O3
MOLECULAR WEIGHT: 362.85052
SMILES: C1CN(CCC1CC2(OCCO2)C3=CC4=CC=CC=C4N3)C(=O)CCl
Structure:
CAS RN: 62515-78-0
CAS Name: 2-[5-[1H-indol-2-yl(oxo)methyl]-3,4-dihydro-2H-pyridin-1-yl]-1-phenylethanone
OPENEYE Name: 2-[5-(1H-indole-2-carbonyl)-3,4-dihydro-2H-pyridin-1-yl]-1-phenyl-ethanone
IUPAC Name: 2-[5-(1H-indole-2-carbonyl)-3,4-dihydro-2H-pyridin-1-yl]-1-phenylethanone
SYSTEMATIC NAME: 2-[5-(1H-indol-2-ylcarbonyl)-3,4-dihydro-2H-pyridin-1-yl]-1-phenyl-ethanone
MOLECULAR FORMULA: C22H20N2O2
MOLECULAR WEIGHT: 344.4064
SMILES: C1CC(=CN(C1)CC(=O)C2=CC=CC=C2)C(=O)C3=CC4=CC=CC=C4N3
Structure:
CAS RN: 62515-80-4
CAS Name: [1-(benzenesulfonyl)-2-indolyl]-[1-(3-hydroxypropyl)-3,4-dihydro-2H-pyridin-5-yl]methanone
OPENEYE Name: [1-(benzenesulfonyl)indol-2-yl]-[1-(3-hydroxypropyl)-3,4-dihydro-2H-pyridin-5-yl]methanone
IUPAC Name: [1-(benzenesulfonyl)indol-2-yl]-[1-(3-hydroxypropyl)-3,4-dihydro-2H-pyridin-5-yl]methanone
SYSTEMATIC NAME: [1-(3-oxidanylpropyl)-3,4-dihydro-2H-pyridin-5-yl]-[1-(phenylsulfonyl)indol-2-yl]methanone
MOLECULAR FORMULA: C23H24N2O4S
MOLECULAR WEIGHT: 424.51266
SMILES: C1CC(=CN(C1)CCCO)C(=O)C2=CC3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4
Structure:
CAS RN: 62515-79-1
CAS Name: [1-(benzenesulfonyl)-2-indolyl]-[1-(2-hydroxy-2-phenylethyl)-3,4-dihydro-2H-pyridin-5-yl]methanone
OPENEYE Name: [1-(benzenesulfonyl)indol-2-yl]-[1-(2-hydroxy-2-phenyl-ethyl)-3,4-dihydro-2H-pyridin-5-yl]methanone
IUPAC Name: [1-(benzenesulfonyl)indol-2-yl]-[1-(2-hydroxy-2-phenylethyl)-3,4-dihydro-2H-pyridin-5-yl]methanone
SYSTEMATIC NAME: [1-(2-oxidanyl-2-phenyl-ethyl)-3,4-dihydro-2H-pyridin-5-yl]-[1-(phenylsulfonyl)indol-2-yl]methanone
MOLECULAR FORMULA: C28H26N2O4S
MOLECULAR WEIGHT: 486.58204
SMILES: C1CC(=CN(C1)CC(C2=CC=CC=C2)O)C(=O)C3=CC4=CC=CC=C4N3S(=O)(=O)C5=CC=CC=C5
Structure:
CAS RN: 4026-96-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C26H34O6
MOLECULAR WEIGHT: 442.54456
SMILES: CC(=O)OC1CCC2(C(C1)CCC3C2CCC4(C35C(O5)C(C4C6=COC(=O)C=C6)O)C)C
Structure:
CAS RN: 39707-16-9
CAS Name: acetic acid [15-chloro-14-hydroxy-10,13-dimethyl-17-(6-oxo-3-pyranyl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] ester
OPENEYE Name: [15-chloro-14-hydroxy-10,13-dimethyl-17-(6-oxopyran-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate
IUPAC Name: [15-chloro-14-hydroxy-10,13-dimethyl-17-(6-oxopyran-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate
SYSTEMATIC NAME: [15-chloranyl-10,13-dimethyl-14-oxidanyl-17-(6-oxidanylidenepyran-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] ethanoate
MOLECULAR FORMULA: C26H35ClO5
MOLECULAR WEIGHT: 463.0061
SMILES: CC(=O)OC1CCC2(C(C1)CCC3C2CCC4(C3(C(CC4C5=COC(=O)C=C5)Cl)O)C)C
Structure:
CAS RN: 42515-43-5
CAS Name: acetic acid [(3S,5R,8R,9S,10S,13R,14S,15S)-14-chloro-15-hydroxy-10,13-dimethyl-17-(6-oxo-3-pyranyl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] ester
OPENEYE Name: [(3S,5R,8R,9S,10S,13R,14S,15S)-14-chloro-15-hydroxy-10,13-dimethyl-17-(6-oxopyran-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate
IUPAC Name: [(3S,5R,8R,9S,10S,13R,14S,15S)-14-chloro-15-hydroxy-10,13-dimethyl-17-(6-oxopyran-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate
SYSTEMATIC NAME: [(3S,5R,8R,9S,10S,13R,14S,15S)-14-chloranyl-10,13-dimethyl-15-oxidanyl-17-(6-oxidanylidenepyran-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] ethanoate
MOLECULAR FORMULA: C26H35ClO5
MOLECULAR WEIGHT: 463.0061
SMILES: CC(=O)O[C@H]1CC[C@]2([C@@H](C1)CC[C@@H]3[C@@H]2CC[C@]4([C@@]3([C@H](CC4C5=COC(=O)C=C5)O)Cl)C)C
Structure:
CAS RN: 468-86-0
CAS Name: 5-(3-hydroxy-10,13-dimethyl-15-oxo-1,2,3,4,5,6,7,8,9,11,12,14,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)-2-pyranone
OPENEYE Name: 5-(3-hydroxy-10,13-dimethyl-15-oxo-1,2,3,4,5,6,7,8,9,11,12,14,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pyran-2-one
IUPAC Name: 5-(3-hydroxy-10,13-dimethyl-15-oxo-1,2,3,4,5,6,7,8,9,11,12,14,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pyran-2-one
SYSTEMATIC NAME: 5-(10,13-dimethyl-3-oxidanyl-15-oxidanylidene-1,2,3,4,5,6,7,8,9,11,12,14,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pyran-2-one
MOLECULAR FORMULA: C24H32O4
MOLECULAR WEIGHT: 384.50848
SMILES: CC12CCC(CC1CCC3C2CCC4(C3C(=O)CC4C5=COC(=O)C=C5)C)O
Structure:
CAS RN: 39876-56-7
CAS Name: 2-(2-carboxyethenyl)-5-methyl-4-oxo-1H-pyrimidine-6-carboxylic acid
OPENEYE Name: 2-(2-carboxyvinyl)-5-methyl-4-oxo-1H-pyrimidine-6-carboxylic acid
IUPAC Name: 2-(2-carboxyethenyl)-5-methyl-4-oxo-1H-pyrimidine-6-carboxylic acid
SYSTEMATIC NAME: 5-methyl-4-oxidanylidene-2-(3-oxidanyl-3-oxidanylidene-prop-1-enyl)-1H-pyrimidine-6-carboxylic acid
MOLECULAR FORMULA: C9H8N2O5
MOLECULAR WEIGHT: 224.17022
SMILES: CC1=C(NC(=NC1=O)C=CC(=O)O)C(=O)O
Structure:
CAS RN: 17874-79-2
CAS Name: 5-methoxycarbonyl-2-pyridinecarboxylic acid
OPENEYE Name: 5-methoxycarbonylpyridine-2-carboxylic acid
IUPAC Name: 5-methoxycarbonylpyridine-2-carboxylic acid
SYSTEMATIC NAME: 5-methoxycarbonylpyridine-2-carboxylic acid
MOLECULAR FORMULA: C8H7NO4
MOLECULAR WEIGHT: 181.14548
SMILES: COC(=O)C1=CN=C(C=C1)C(=O)O
Structure:
CAS RN: 4631-21-4
CAS Name: 2-(hydroxymethyl)-6-methoxy-4-nitrooxane-3,5-diol
OPENEYE Name: 2-(hydroxymethyl)-6-methoxy-4-nitro-tetrahydropyran-3,5-diol
IUPAC Name: 2-(hydroxymethyl)-6-methoxy-4-nitrooxane-3,5-diol
SYSTEMATIC NAME: 2-(hydroxymethyl)-6-methoxy-4-nitro-oxane-3,5-diol
MOLECULAR FORMULA: C7H13NO7
MOLECULAR WEIGHT: 223.18062
SMILES: COC1C(C(C(C(O1)CO)O)[N+](=O)[O-])O
Structure:
CAS RN: 14133-36-9
CAS Name: 4-amino-2-(hydroxymethyl)-6-methoxyoxane-3,5-diol
OPENEYE Name: 4-amino-2-(hydroxymethyl)-6-methoxy-tetrahydropyran-3,5-diol
IUPAC Name: 4-amino-2-(hydroxymethyl)-6-methoxyoxane-3,5-diol
SYSTEMATIC NAME: 4-azanyl-2-(hydroxymethyl)-6-methoxy-oxane-3,5-diol
MOLECULAR FORMULA: C7H15NO5
MOLECULAR WEIGHT: 193.1977
SMILES: COC1C(C(C(C(O1)CO)O)N)O
Structure:
CAS RN: 60106-94-7
CAS Name: 2-chloro-N-[chloro(diethylamino)phosphoryl]ethanamine
OPENEYE Name: 2-chloro-N-[chloro(diethylamino)phosphoryl]ethanamine
IUPAC Name: 2-chloro-N-[chloro(diethylamino)phosphoryl]ethanamine
SYSTEMATIC NAME: 2-chloranyl-N-[chloranyl(diethylamino)phosphoryl]ethanamine
MOLECULAR FORMULA: C6H15Cl2N2OP
MOLECULAR WEIGHT: 233.075861
SMILES: CCN(CC)P(=O)(NCCCl)Cl
Structure:
CAS RN: 37979-67-2
CAS Name: 3-[amino-[bis(2-chloroethyl)amino]phosphoryl]oxypropanoic acid (phenylmethyl) ester
OPENEYE Name: benzyl 3-[amino-[bis(2-chloroethyl)amino]phosphoryl]oxypropanoate
IUPAC Name: benzyl 3-[amino-[bis(2-chloroethyl)amino]phosphoryl]oxypropanoate
SYSTEMATIC NAME: (phenylmethyl) 3-[azanyl-[bis(2-chloroethyl)amino]phosphoryl]oxypropanoate
MOLECULAR FORMULA: C14H21Cl2N2O4P
MOLECULAR WEIGHT: 383.207301
SMILES: C1=CC=C(C=C1)COC(=O)CCOP(=O)(N)N(CCCl)CCCl
Structure:
CAS RN: 13148-14-6
CAS Name: 3'-phenyl-1-spiro[3H-indene-2,2'-oxirane]one
OPENEYE Name: 3'-phenylspiro[indane-2,2'-oxirane]-1-one
IUPAC Name: 3'-phenylspiro[3H-indene-2,2'-oxirane]-1-one
SYSTEMATIC NAME: 3'-phenylspiro[3H-indene-2,2'-oxirane]-1-one
MOLECULAR FORMULA: C16H12O2
MOLECULAR WEIGHT: 236.26528
SMILES: C1C2=CC=CC=C2C(=O)C13C(O3)C4=CC=CC=C4
Structure:
CAS RN: 57090-63-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C30H48F2O2
MOLECULAR WEIGHT: 478.697726
SMILES: CC(C)CCCC(C)C1CCC2C1(CCC3C2CC4C5(C3(CCC6(C5)OCCO6)C)C4(F)F)C
Structure:
CAS RN: 52431-61-5
CAS Name: 5-chloro-8-hydroxy-6-methylnaphthalene-1,4-dione
OPENEYE Name: 5-chloro-8-hydroxy-6-methyl-naphthalene-1,4-dione
IUPAC Name: 5-chloro-8-hydroxy-6-methylnaphthalene-1,4-dione
SYSTEMATIC NAME: 5-chloranyl-6-methyl-8-oxidanyl-naphthalene-1,4-dione
MOLECULAR FORMULA: C11H7ClO3
MOLECULAR WEIGHT: 222.62448
SMILES: CC1=CC(=C2C(=O)C=CC(=O)C2=C1Cl)O
Structure:
CAS RN: 19579-63-6
CAS Name: 3-hydroxy-3-(1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-1H-indol-2-one
OPENEYE Name: 3-hydroxy-3-(1-oxotetralin-2-yl)indolin-2-one
IUPAC Name: 3-hydroxy-3-(1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-1H-indol-2-one
SYSTEMATIC NAME: 3-oxidanyl-3-(1-oxidanylidene-3,4-dihydro-2H-naphthalen-2-yl)-1H-indol-2-one
MOLECULAR FORMULA: C18H15NO3
MOLECULAR WEIGHT: 293.3166
SMILES: C1CC2=CC=CC=C2C(=O)C1C3(C4=CC=CC=C4NC3=O)O
Structure:
CAS RN: 76325-80-9
CAS Name: 3-[2-(1-adamantyl)-2-oxoethyl]-3-hydroxy-1H-indol-2-one
OPENEYE Name: 3-[2-(1-adamantyl)-2-oxo-ethyl]-3-hydroxy-indolin-2-one
IUPAC Name: 3-[2-(1-adamantyl)-2-oxoethyl]-3-hydroxy-1H-indol-2-one
SYSTEMATIC NAME: 3-[2-(1-adamantyl)-2-oxidanylidene-ethyl]-3-oxidanyl-1H-indol-2-one
MOLECULAR FORMULA: C20H23NO3
MOLECULAR WEIGHT: 325.40152
SMILES: C1C2CC3CC1CC(C2)(C3)C(=O)CC4(C5=CC=CC=C5NC4=O)O
Structure:
CAS RN: 51008-02-7
CAS Name: 1-hydroperoxy-1-(1-hydroperoxycycloheptyl)dioxycycloheptane
OPENEYE Name: 1-hydroperoxy-1-(1-hydroperoxycycloheptyl)peroxy-cycloheptane
IUPAC Name: 1-hydroperoxy-1-(1-hydroperoxycycloheptyl)peroxycycloheptane
SYSTEMATIC NAME: 1-(dioxidanyl)-1-[1-(dioxidanyl)cycloheptyl]peroxy-cycloheptane
MOLECULAR FORMULA: C14H26O6
MOLECULAR WEIGHT: 290.35264
SMILES: C1CCCC(CC1)(OO)OOC2(CCCCCC2)OO
Structure:
CAS RN: 13035-03-5
CAS Name: 1-hydroperoxy-1-(1-hydroperoxy-4-methylcyclohexyl)dioxy-4-methylcyclohexane
OPENEYE Name: 1-hydroperoxy-1-(1-hydroperoxy-4-methyl-cyclohexyl)peroxy-4-methyl-cyclohexane
IUPAC Name: 1-hydroperoxy-1-(1-hydroperoxy-4-methylcyclohexyl)peroxy-4-methylcyclohexane
SYSTEMATIC NAME: 1-(dioxidanyl)-1-[1-(dioxidanyl)-4-methyl-cyclohexyl]peroxy-4-methyl-cyclohexane
MOLECULAR FORMULA: C14H26O6
MOLECULAR WEIGHT: 290.35264
SMILES: CC1CCC(CC1)(OO)OOC2(CCC(CC2)C)OO
Structure:
CAS RN: 6789-46-4
CAS Name: 6,7,14,15,22,23-hexaoxatrispiro[4.2.5^{8}.2.5^{16}.2^{5}]tricosane
OPENEYE Name: 6,7,14,15,22,23-hexaoxatrispiro[4.2.5^{8}.2.5^{16}.2^{5}]tricosane
IUPAC Name: 6,7,14,15,22,23-hexaoxatrispiro[4.2.5^{8}.2.5^{16}.2^{5}]tricosane
SYSTEMATIC NAME: 6,7,14,15,22,23-hexaoxatrispiro[4.2.5^{8}.2.5^{16}.2^{5}]tricosane
MOLECULAR FORMULA: C17H28O6
MOLECULAR WEIGHT: 328.40062
SMILES: C1CCC2(CC1)OOC3(CCCCC3)OOC4(CCCC4)OO2
Structure:
CAS RN: 55208-76-9
CAS Name: 3,3,6,6-tetrapropyl-1,2,4,5-tetraoxane
OPENEYE Name: 3,3,6,6-tetrapropyl-1,2,4,5-tetraoxane
IUPAC Name: 3,3,6,6-tetrapropyl-1,2,4,5-tetraoxane
SYSTEMATIC NAME: 3,3,6,6-tetrapropyl-1,2,4,5-tetraoxane
MOLECULAR FORMULA: C14H28O4
MOLECULAR WEIGHT: 260.36972
SMILES: CCCC1(OOC(OO1)(CCC)CCC)CCC
Structure:
CAS RN: 2699-12-9
CAS Name: 1-hydroperoxy-1-(1-hydroperoxycyclohexyl)dioxycyclohexane
OPENEYE Name: 1-hydroperoxy-1-(1-hydroperoxycyclohexyl)peroxy-cyclohexane
IUPAC Name: 1-hydroperoxy-1-(1-hydroperoxycyclohexyl)peroxycyclohexane
SYSTEMATIC NAME: 1-(dioxidanyl)-1-[1-(dioxidanyl)cyclohexyl]peroxy-cyclohexane
MOLECULAR FORMULA: C12H22O6
MOLECULAR WEIGHT: 262.29948
SMILES: C1CCC(CC1)(OO)OOC2(CCCCC2)OO
Structure:
CAS RN: 59324-40-2
CAS Name: 17-(2-aminoethyl)-10,13-dimethyl-3-(2-oxanyloxy)-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ol
OPENEYE Name: 17-(2-aminoethyl)-10,13-dimethyl-3-tetrahydropyran-2-yloxy-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ol
IUPAC Name: 17-(2-aminoethyl)-10,13-dimethyl-3-(oxan-2-yloxy)-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ol
SYSTEMATIC NAME: 17-(2-azanylethyl)-10,13-dimethyl-3-(oxan-2-yloxy)-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ol
MOLECULAR FORMULA: C26H43NO3
MOLECULAR WEIGHT: 417.62452
SMILES: CC12CCC(CC1=CCC3C2CCC4(C3CCC4(CCN)O)C)OC5CCCCO5
Structure:
CAS RN: 58747-64-1
CAS Name: 7-benzoylindolizine-1,2-dicarboxylic acid dimethyl ester
OPENEYE Name: dimethyl 7-benzoylindolizine-1,2-dicarboxylate
IUPAC Name: dimethyl 7-benzoylindolizine-1,2-dicarboxylate
SYSTEMATIC NAME: dimethyl 7-(phenylcarbonyl)indolizine-1,2-dicarboxylate
MOLECULAR FORMULA: C19H15NO5
MOLECULAR WEIGHT: 337.3261
SMILES: COC(=O)C1=CN2C=CC(=CC2=C1C(=O)OC)C(=O)C3=CC=CC=C3
Structure:
CAS RN: 37394-61-9
CAS Name: 1-hydroxy-4-(1-hydroxy-3,5-diphenyl-4-pyrazolyl)-3,5-diphenylpyrazole
OPENEYE Name: 1-hydroxy-4-(1-hydroxy-3,5-diphenyl-pyrazol-4-yl)-3,5-diphenyl-pyrazole
IUPAC Name: 1-hydroxy-4-(1-hydroxy-3,5-diphenylpyrazol-4-yl)-3,5-diphenylpyrazole
SYSTEMATIC NAME: 1-oxidanyl-4-(1-oxidanyl-3,5-diphenyl-pyrazol-4-yl)-3,5-diphenyl-pyrazole
MOLECULAR FORMULA: C30H22N4O2
MOLECULAR WEIGHT: 470.52128
SMILES: C1=CC=C(C=C1)C2=C(C(=NN2O)C3=CC=CC=C3)C4=C(N(N=C4C5=CC=CC=C5)O)C6=CC=CC=C6
Structure:
CAS RN: 39012-16-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H28O7
MOLECULAR WEIGHT: 404.45352
SMILES: CCCCCC1CC2=C(CC(CC3=C1C(=O)OC3=O)(CCCC)O)C(=O)OC2=O
Structure:
CAS RN: 77063-19-5
CAS Name: 4-[4-[bis(2-chloroethyl)amino]phenyl]butanoic acid pentyl ester
OPENEYE Name: pentyl 4-[4-[bis(2-chloroethyl)amino]phenyl]butanoate
IUPAC Name: pentyl 4-[4-[bis(2-chloroethyl)amino]phenyl]butanoate
SYSTEMATIC NAME: pentyl 4-[4-[bis(2-chloroethyl)amino]phenyl]butanoate
MOLECULAR FORMULA: C19H29Cl2NO2
MOLECULAR WEIGHT: 374.34506
SMILES: CCCCCOC(=O)CCCC1=CC=C(C=C1)N(CCCl)CCCl
Structure:
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