CAS RN: 64054-15-5
CAS Name: 3'-oxo-1'-spiro[cyclopropane-1,2'-indole]carboxylic acid ethyl ester
OPENEYE Name: ethyl 3'-oxospiro[cyclopropane-1,2'-indoline]-1'-carboxylate
IUPAC Name: ethyl 3'-oxospiro[cyclopropane-1,2'-indole]-1'-carboxylate
SYSTEMATIC NAME: ethyl 3'-oxidanylidenespiro[cyclopropane-1,2'-indole]-1'-carboxylate
MOLECULAR FORMULA: C13H13NO3
MOLECULAR WEIGHT: 231.24722
SMILES: CCOC(=O)N1C2=CC=CC=C2C(=O)C13CC3
Structure:
CAS RN: 64054-05-3
CAS Name: 1'-acetyl-5'-methyl-3'-spiro[cyclopropane-1,2'-indole]one
OPENEYE Name: 1'-acetyl-5'-methyl-spiro[cyclopropane-1,2'-indoline]-3'-one
IUPAC Name: 1'-acetyl-5'-methylspiro[cyclopropane-1,2'-indole]-3'-one
SYSTEMATIC NAME: 1'-ethanoyl-5'-methyl-spiro[cyclopropane-1,2'-indole]-3'-one
MOLECULAR FORMULA: C13H13NO2
MOLECULAR WEIGHT: 215.24782
SMILES: CC1=CC2=C(C=C1)N(C3(C2=O)CC3)C(=O)C
Structure:
CAS RN: 64053-88-9
CAS Name: 1'-acetyl-5'-methoxy-3'-spiro[cyclopropane-1,2'-indole]one
OPENEYE Name: 1'-acetyl-5'-methoxy-spiro[cyclopropane-1,2'-indoline]-3'-one
IUPAC Name: 1'-acetyl-5'-methoxyspiro[cyclopropane-1,2'-indole]-3'-one
SYSTEMATIC NAME: 1'-ethanoyl-5'-methoxy-spiro[cyclopropane-1,2'-indole]-3'-one
MOLECULAR FORMULA: C13H13NO3
MOLECULAR WEIGHT: 231.24722
SMILES: CC(=O)N1C2=C(C=C(C=C2)OC)C(=O)C13CC3
Structure:
CAS RN: 64053-86-7
CAS Name: 1'-methyl-3'-spiro[cyclopropane-1,2'-indole]one
OPENEYE Name: 1'-methylspiro[cyclopropane-1,2'-indoline]-3'-one
IUPAC Name: 1'-methylspiro[cyclopropane-1,2'-indole]-3'-one
SYSTEMATIC NAME: 1'-methylspiro[cyclopropane-1,2'-indole]-3'-one
MOLECULAR FORMULA: C11H11NO
MOLECULAR WEIGHT: 173.21114
SMILES: CN1C2=CC=CC=C2C(=O)C13CC3
Structure:
CAS RN: 64053-82-3
CAS Name: 3'-oxo-1'-spiro[cyclopropane-1,2'-indole]carboxaldehyde
OPENEYE Name: 3'-oxospiro[cyclopropane-1,2'-indoline]-1'-carbaldehyde
IUPAC Name: 3'-oxospiro[cyclopropane-1,2'-indole]-1'-carbaldehyde
SYSTEMATIC NAME: 3'-oxidanylidenespiro[cyclopropane-1,2'-indole]-1'-carbaldehyde
MOLECULAR FORMULA: C11H9NO2
MOLECULAR WEIGHT: 187.19466
SMILES: C1CC12C(=O)C3=CC=CC=C3N2C=O
Structure:
CAS RN: 64053-80-1
CAS Name: 1'-acetyl-3'-spiro[cyclopropane-1,2'-indole]one
OPENEYE Name: 1'-acetylspiro[cyclopropane-1,2'-indoline]-3'-one
IUPAC Name: 1'-acetylspiro[cyclopropane-1,2'-indole]-3'-one
SYSTEMATIC NAME: 1'-ethanoylspiro[cyclopropane-1,2'-indole]-3'-one
MOLECULAR FORMULA: C12H11NO2
MOLECULAR WEIGHT: 201.22124
SMILES: CC(=O)N1C2=CC=CC=C2C(=O)C13CC3
Structure:
CAS RN: 64053-78-7
CAS Name: 3-spiro[1H-indole-2,1'-cyclopropane]one
OPENEYE Name: spiro[cyclopropane-1,2'-indoline]-3'-one
IUPAC Name: spiro[1H-indole-2,1'-cyclopropane]-3-one
SYSTEMATIC NAME: spiro[1H-indole-2,1'-cyclopropane]-3-one
MOLECULAR FORMULA: C10H9NO
MOLECULAR WEIGHT: 159.18456
SMILES: C1CC12C(=O)C3=CC=CC=C3N2
Structure:
CAS RN: 64047-40-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H15N
MOLECULAR WEIGHT: 305.3719
SMILES: CC1=CC2=C(C=C1)NC3=C2C=CC4=C5C=CC=C6C5=C(C=C6)C=C43
Structure:
CAS RN: 64047-38-7
CAS Name: trimethyl-[3-[(2-nitrophenyl)-oxomethoxy]phenyl]ammonium bromide
OPENEYE Name: trimethyl-[3-(2-nitrobenzoyl)oxyphenyl]ammonium bromide
IUPAC Name: trimethyl-[3-(2-nitrobenzoyl)oxyphenyl]azanium bromide
SYSTEMATIC NAME: trimethyl-[3-(2-nitrophenyl)carbonyloxyphenyl]azanium bromide
MOLECULAR FORMULA: C16H17BrN2O4
MOLECULAR WEIGHT: 381.22118
SMILES: C[N+](C)(C)C1=CC(=CC=C1)OC(=O)C2=CC=CC=C2[N+](=O)[O-].[Br-]
Structure:
CAS RN: 64047-32-1
CAS Name: (2,3-dimethylphenyl)arsonic acid
OPENEYE Name: (2,3-dimethylphenyl)arsonic acid
IUPAC Name: (2,3-dimethylphenyl)arsonic acid
SYSTEMATIC NAME: (2,3-dimethylphenyl)arsonic acid
MOLECULAR FORMULA: C8H11AsO3
MOLECULAR WEIGHT: 230.09274
SMILES: CC1=C(C(=CC=C1)[As](=O)(O)O)C
Structure:
CAS RN: 64047-26-3
CAS Name: N-[4-(diethylamino)-3,3-dimethylbutyl]carbamodithioate; mercury(2+); dihydrochloride
OPENEYE Name: mercuric N-[4-(diethylamino)-3,3-dimethyl-butyl]carbamodithioate dihydrochloride
IUPAC Name: N-[4-(diethylamino)-3,3-dimethylbutyl]carbamodithioate; mercury(2+); dihydrochloride
SYSTEMATIC NAME: N-[4-(diethylamino)-3,3-dimethyl-butyl]carbamodithioate; mercury(2+); dihydrochloride
MOLECULAR FORMULA: C22H48Cl2HgN4S4
MOLECULAR WEIGHT: 768.39932
SMILES: CCN(CC)CC(C)(C)CCNC(=S)[S-].CCN(CC)CC(C)(C)CCNC(=S)[S-].Cl.Cl.[Hg+2]
Structure:
CAS RN: 64046-68-0
CAS Name: calcium strontium tetraacetate
OPENEYE Name: calcium strontium tetraacetate
IUPAC Name: calcium strontium tetraacetate
SYSTEMATIC NAME: calcium strontium tetraethanoate
MOLECULAR FORMULA: C8H12CaO8Sr
MOLECULAR WEIGHT: 363.87408
SMILES: CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Ca+2].[Sr+2]
Structure:
CAS RN: 64046-00-0
CAS Name: ammonium potassium selenium(2-)
OPENEYE Name: ammonium potassium selenium(2-)
IUPAC Name: azanium potassium selenium(2-)
SYSTEMATIC NAME: azanium potassium selenium(2-)
MOLECULAR FORMULA: H4KNSe
MOLECULAR WEIGHT: 136.09676
SMILES: [NH4+].[K+].[Se-2]
Structure:
CAS RN: 64044-05-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H34ClNO2
MOLECULAR WEIGHT: 379.96386
SMILES: CC1C2CCC3C(C2)(C1=O)CCC4C35CCCC4(CN6C5OCC6)C.Cl
Structure:
CAS RN: 64043-80-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H23NO
MOLECULAR WEIGHT: 245.35992
SMILES: CC[C@@]12CCN([C@H]([C@H]1C)CC3=C2C=C(C=C3)O)C
Structure:
CAS RN: 64043-55-6
CAS Name: 4-[(Z)-4-(4-hydroxyphenyl)-5,5,6,6-tetraiodohex-3-en-3-yl]phenol
OPENEYE Name: 4-[(Z)-1-ethyl-2-(4-hydroxyphenyl)-3,3,4,4-tetraiodo-but-1-enyl]phenol
IUPAC Name: 4-[(Z)-4-(4-hydroxyphenyl)-5,5,6,6-tetraiodohex-3-en-3-yl]phenol
SYSTEMATIC NAME: 4-[(Z)-4-(4-hydroxyphenyl)-5,5,6,6-tetrakis(iodanyl)hex-3-en-3-yl]phenol
MOLECULAR FORMULA: C18H16I4O2
MOLECULAR WEIGHT: 771.93632
SMILES: CC/C(=C(\C1=CC=C(C=C1)O)/C(C(I)I)(I)I)/C2=CC=C(C=C2)O
Structure:
CAS RN: 64043-30-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H23NO
MOLECULAR WEIGHT: 245.35992
SMILES: CC[C@@H]1[C@@H]2CC3=C([C@@]1(CCN2C)C)C=C(C=C3)O
Structure:
CAS RN: 64039-27-6
CAS Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-3H-purine-6-thione hydrate
OPENEYE Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purine-6-thione hydrate
IUPAC Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-6-thione hydrate
SYSTEMATIC NAME: 2-azanyl-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-3H-purine-6-thione hydrate
MOLECULAR FORMULA: C10H15N5O4S
MOLECULAR WEIGHT: 301.3222
SMILES: C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC(=NC3=S)N)CO)O.O
Structure:
CAS RN: 64038-47-7
CAS Name: calcium 2-[[butoxy(sulfanylidene)methyl]thio]acetate
OPENEYE Name: calcium 2-butoxycarbothioylsulfanylacetate
IUPAC Name: calcium 2-butoxycarbothioylsulfanylacetate
SYSTEMATIC NAME: calcium 2-butoxycarbothioylsulfanylethanoate
MOLECULAR FORMULA: C14H22CaO6S4
MOLECULAR WEIGHT: 454.65888
SMILES: CCCCOC(=S)SCC(=O)[O-].CCCCOC(=S)SCC(=O)[O-].[Ca+2]
Structure:
CAS RN: 64036-89-1
CAS Name: N,N-dimethylcarbamic acid (1,1-dimethyl-3,4-dihydro-2H-quinolin-1-ium-8-yl) ester iodide
OPENEYE Name: (1,1-dimethyl-3,4-dihydro-2H-quinolin-1-ium-8-yl) N,N-dimethylcarbamate iodide
IUPAC Name: (1,1-dimethyl-3,4-dihydro-2H-quinolin-1-ium-8-yl) N,N-dimethylcarbamate iodide
SYSTEMATIC NAME: (1,1-dimethyl-3,4-dihydro-2H-quinolin-1-ium-8-yl) N,N-dimethylcarbamate iodide
MOLECULAR FORMULA: C14H21IN2O2
MOLECULAR WEIGHT: 376.23321
SMILES: CN(C)C(=O)OC1=CC=CC2=C1[N+](CCC2)(C)C.[I-]
Structure:
CAS RN: 64026-55-7
CAS Name: 2-[[1-oxo-2-(2-oxo-1-pyrrolidinyl)ethyl]amino]acetamide
OPENEYE Name: 2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]acetamide
IUPAC Name: 2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]acetamide
SYSTEMATIC NAME: 2-[2-(2-oxidanylidenepyrrolidin-1-yl)ethanoylamino]ethanamide
MOLECULAR FORMULA: C8H13N3O3
MOLECULAR WEIGHT: 199.20712
SMILES: C1CC(=O)N(C1)CC(=O)NCC(=O)N
Structure:
CAS RN: 64024-08-4
CAS Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; urea
OPENEYE Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; urea
IUPAC Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; urea
SYSTEMATIC NAME: antimony(3+); 2,3-bis(oxidanidyl)butanedioate; hydron; urea
MOLECULAR FORMULA: C9H10N2O13Sb2
MOLECULAR WEIGHT: 597.7013
SMILES: [H+].[H+].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(=O)(N)N.[Sb+3].[Sb+3]
Structure:
CAS RN: 64023-90-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H27NO
MOLECULAR WEIGHT: 273.41308
SMILES: CCCCCC12CCN(C(C1)CC3=C2C=C(C=C3)O)C
Structure:
CAS RN: 64023-89-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H25NO
MOLECULAR WEIGHT: 259.3865
SMILES: CCCCC12CCN(C(C1)CC3=C2C=C(C=C3)O)C
Structure:
CAS RN: 64023-71-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H23NO
MOLECULAR WEIGHT: 245.35992
SMILES: CC[C@@]12CCN([C@H]([C@@H]1C)CC3=C2C=C(C=C3)O)C
Structure:
CAS RN: 64019-15-4
CAS Name: 2-(2H-tetrazol-5-yl)-11-pyrido[2,1-b]quinazolinone
OPENEYE Name: 2-(2H-tetrazol-5-yl)pyrido[2,1-b]quinazolin-11-one
IUPAC Name: 2-(2H-tetrazol-5-yl)pyrido[2,1-b]quinazolin-11-one
SYSTEMATIC NAME: 2-(2H-1,2,3,4-tetrazol-5-yl)pyrido[2,1-b]quinazolin-11-one
MOLECULAR FORMULA: C13H8N6O
MOLECULAR WEIGHT: 264.24222
SMILES: C1=CC2=NC3=C(C=C(C=C3)C4=NNN=N4)C(=O)N2C=C1
Structure:
CAS RN: 64011-36-5
CAS Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 4-methylaniline
OPENEYE Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 4-methylaniline
IUPAC Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 4-methylaniline
SYSTEMATIC NAME: antimony(3+); 2,3-bis(oxidanidyl)butanedioate; hydron; 4-methylaniline
MOLECULAR FORMULA: C22H24N2O12Sb2
MOLECULAR WEIGHT: 751.95216
SMILES: [H+].[H+].CC1=CC=C(C=C1)N.CC1=CC=C(C=C1)N.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]
Structure:
CAS RN: 64011-35-4
CAS Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 2-methylaniline
OPENEYE Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 2-methylaniline
IUPAC Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 2-methylaniline
SYSTEMATIC NAME: antimony(3+); 2,3-bis(oxidanidyl)butanedioate; hydron; 2-methylaniline
MOLECULAR FORMULA: C22H24N2O12Sb2
MOLECULAR WEIGHT: 751.95216
SMILES: [H+].[H+].CC1=CC=CC=C1N.CC1=CC=CC=C1N.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]
Structure:
CAS RN: 64011-34-3
CAS Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 3-methylaniline
OPENEYE Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 3-methylaniline
IUPAC Name: antimony(3+); 2,3-dioxidobutanedioate; hydron; 3-methylaniline
SYSTEMATIC NAME: antimony(3+); 2,3-bis(oxidanidyl)butanedioate; hydron; 3-methylaniline
MOLECULAR FORMULA: C22H24N2O12Sb2
MOLECULAR WEIGHT: 751.95216
SMILES: [H+].[H+].CC1=CC(=CC=C1)N.CC1=CC(=CC=C1)N.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]
Structure:
CAS RN: 64011-29-6
CAS Name: zinc 4-amino-2-(trifluoromethyl)benzenethiolate
OPENEYE Name: zinc 4-amino-2-(trifluoromethyl)benzenethiolate
IUPAC Name: zinc 4-amino-2-(trifluoromethyl)benzenethiolate
SYSTEMATIC NAME: zinc 4-azanyl-2-(trifluoromethyl)benzenethiolate
MOLECULAR FORMULA: C14H10F6N2S2Zn
MOLECULAR WEIGHT: 449.772019
SMILES: C1=CC(=C(C=C1N)C(F)(F)F)[S-].C1=CC(=C(C=C1N)C(F)(F)F)[S-].[Zn+2]
Structure:
CAS RN: 64000-85-7
CAS Name: N-methyl-5-(methylamino)-3-oxo-2H-1,2,4-triazine-6-carboxamide
OPENEYE Name: N-methyl-5-(methylamino)-3-oxo-2H-1,2,4-triazine-6-carboxamide
IUPAC Name: N-methyl-5-(methylamino)-3-oxo-2H-1,2,4-triazine-6-carboxamide
SYSTEMATIC NAME: N-methyl-5-(methylamino)-3-oxidanylidene-2H-1,2,4-triazine-6-carboxamide
MOLECULAR FORMULA: C6H9N5O2
MOLECULAR WEIGHT: 183.16796
SMILES: CNC1=NC(=O)NN=C1C(=O)NC
Structure:
CAS RN: 63998-46-9
CAS Name: 1-(2-methyl-2,3-dihydrobenzofuran-5-yl)-1-propanone
OPENEYE Name: 1-(2-methyl-2,3-dihydrobenzofuran-5-yl)propan-1-one
IUPAC Name: 1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)propan-1-one
SYSTEMATIC NAME: 1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)propan-1-one
MOLECULAR FORMULA: C12H14O2
MOLECULAR WEIGHT: 190.23836
SMILES: CCC(=O)C1=CC2=C(C=C1)OC(C2)C
Structure:
CAS RN: 63998-38-9
CAS Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-[3-(2-methoxyethoxy)propylamino]-1-propanol hydrochloride
OPENEYE Name: 1-indan-5-yl-2-[3-(2-methoxyethoxy)propylamino]propan-1-ol hydrochloride
IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-[3-(2-methoxyethoxy)propylamino]propan-1-ol hydrochloride
SYSTEMATIC NAME: 1-(2,3-dihydro-1H-inden-5-yl)-2-[3-(2-methoxyethoxy)propylamino]propan-1-ol hydrochloride
MOLECULAR FORMULA: C18H30ClNO3
MOLECULAR WEIGHT: 343.8887
SMILES: CC(C(C1=CC2=C(CCC2)C=C1)O)NCCCOCCOC.Cl
Structure:
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