CAS RN: 50355-79-8
CAS Name: N-ethyl-N-[(1-oxido-3-pyridin-1-iumyl)azo]ethanamine
OPENEYE Name: N-ethyl-N-(1-oxidopyridin-1-ium-3-yl)azo-ethanamine
IUPAC Name: N-ethyl-N-[(1-oxidopyridin-1-ium-3-yl)diazenyl]ethanamine
SYSTEMATIC NAME: N-ethyl-N-[(1-oxidanidylpyridin-1-ium-3-yl)diazenyl]ethanamine
MOLECULAR FORMULA: C9H14N4O
MOLECULAR WEIGHT: 194.23366
SMILES: CCN(CC)N=NC1=C[N+](=CC=C1)[O-]
Structure:
CAS RN: 5410-66-2
CAS Name: N-methyl-1-phenyl-N-phenyldiazenylmethanamine
OPENEYE Name: N-methyl-1-phenyl-N-phenylazo-methanamine
IUPAC Name: N-methyl-1-phenyl-N-phenyldiazenylmethanamine
SYSTEMATIC NAME: N-methyl-1-phenyl-N-phenyldiazenyl-methanamine
MOLECULAR FORMULA: C14H15N3
MOLECULAR WEIGHT: 225.289
SMILES: CN(CC1=CC=CC=C1)N=NC2=CC=CC=C2
Structure:
CAS RN: 59907-12-9
CAS Name: (3aS,5R,5aR,8aS,9aR)-5,8a-dimethyl-1-methylene-3a,4,5,5a,9,9a-hexahydroazuleno[6,7-b]furan-2,8-dione
OPENEYE Name: (3aS,5R,5aR,8aS,9aR)-5,8a-dimethyl-1-methylene-3a,4,5,5a,9,9a-hexahydroazuleno[6,7-b]furan-2,8-dione
IUPAC Name: (3aS,5R,5aR,8aS,9aR)-5,8a-dimethyl-1-methylidene-3a,4,5,5a,9,9a-hexahydroazuleno[6,7-b]furan-2,8-dione
SYSTEMATIC NAME: (3aS,5R,5aR,8aS,9aR)-5,8a-dimethyl-1-methylidene-3a,4,5,5a,9,9a-hexahydroazuleno[6,7-b]furan-2,8-dione
MOLECULAR FORMULA: C15H18O3
MOLECULAR WEIGHT: 246.30162
SMILES: C[C@@H]1C[C@H]2[C@H](C[C@]3([C@H]1C=CC3=O)C)C(=C)C(=O)O2
Structure:
CAS RN: 5945-42-6
CAS Name: (3aS,5R,5aR,8aS,9aR)-5,8a-dimethyl-1-methylene-3a,4,5,5a,9,9a-hexahydroazuleno[6,7-b]furan-2,8-dione
OPENEYE Name: (3aS,5R,5aR,8aS,9aR)-5,8a-dimethyl-1-methylene-3a,4,5,5a,9,9a-hexahydroazuleno[6,7-b]furan-2,8-dione
IUPAC Name: (3aS,5R,5aR,8aS,9aR)-5,8a-dimethyl-1-methylidene-3a,4,5,5a,9,9a-hexahydroazuleno[6,7-b]furan-2,8-dione
SYSTEMATIC NAME: (3aS,5R,5aR,8aS,9aR)-5,8a-dimethyl-1-methylidene-3a,4,5,5a,9,9a-hexahydroazuleno[6,7-b]furan-2,8-dione
MOLECULAR FORMULA: C15H18O3
MOLECULAR WEIGHT: 246.30162
SMILES: C[C@@H]1C[C@H]2[C@H](C[C@]3([C@H]1C=CC3=O)C)C(=C)C(=O)O2
Structure:
CAS RN: 92956-90-6
CAS Name: [5-[5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolan-4-yl]methanol
OPENEYE Name: [5-[5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolan-4-yl]methanol
IUPAC Name: [5-[5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolan-4-yl]methanol
SYSTEMATIC NAME: [5-[5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolan-4-yl]methanol
MOLECULAR FORMULA: C12H22O6
MOLECULAR WEIGHT: 262.29948
SMILES: CC1(OC(C(O1)C2C(OC(O2)(C)C)CO)CO)C
Structure:
CAS RN: 10257-13-3
CAS Name: 1-(2-bromoethyl)-3-[2-(1-naphthalenyl)ethyl]urea
OPENEYE Name: 1-(2-bromoethyl)-3-[2-(1-naphthyl)ethyl]urea
IUPAC Name: 1-(2-bromoethyl)-3-(2-naphthalen-1-ylethyl)urea
SYSTEMATIC NAME: 1-(2-bromoethyl)-3-(2-naphthalen-1-ylethyl)urea
MOLECULAR FORMULA: C15H17BrN2O
MOLECULAR WEIGHT: 321.21228
SMILES: C1=CC=C2C(=C1)C=CC=C2CCNC(=O)NCCBr
Structure:
CAS RN: 10256-83-4
CAS Name: 1-(2-bromoethyl)-1-ethyl-3-(1-naphthalenyl)urea
OPENEYE Name: 1-(2-bromoethyl)-1-ethyl-3-(1-naphthyl)urea
IUPAC Name: 1-(2-bromoethyl)-1-ethyl-3-naphthalen-1-ylurea
SYSTEMATIC NAME: 1-(2-bromoethyl)-1-ethyl-3-naphthalen-1-yl-urea
MOLECULAR FORMULA: C15H17BrN2O
MOLECULAR WEIGHT: 321.21228
SMILES: CCN(CCBr)C(=O)NC1=CC=CC2=CC=CC=C21
Structure:
CAS RN: 102571-99-3
CAS Name: 1-(2-bromoethyl)-3-(8-quinolinyl)urea
OPENEYE Name: 1-(2-bromoethyl)-3-(8-quinolyl)urea
IUPAC Name: 1-(2-bromoethyl)-3-quinolin-8-ylurea
SYSTEMATIC NAME: 1-(2-bromoethyl)-3-quinolin-8-yl-urea
MOLECULAR FORMULA: C12H12BrN3O
MOLECULAR WEIGHT: 294.14718
SMILES: C1=CC2=C(C(=C1)NC(=O)NCCBr)N=CC=C2
Structure:
CAS RN: 102694-33-7
CAS Name: 1-(3-ethoxypropyl)-3-(1-naphthalenyl)urea
OPENEYE Name: 1-(3-ethoxypropyl)-3-(1-naphthyl)urea
IUPAC Name: 1-(3-ethoxypropyl)-3-naphthalen-1-ylurea
SYSTEMATIC NAME: 1-(3-ethoxypropyl)-3-naphthalen-1-yl-urea
MOLECULAR FORMULA: C16H20N2O2
MOLECULAR WEIGHT: 272.3422
SMILES: CCOCCCNC(=O)NC1=CC=CC2=CC=CC=C21
Structure:
CAS RN: 102694-30-4
CAS Name: 1-(2-ethoxyethyl)-3-(1-naphthalenyl)urea
OPENEYE Name: 1-(2-ethoxyethyl)-3-(1-naphthyl)urea
IUPAC Name: 1-(2-ethoxyethyl)-3-naphthalen-1-ylurea
SYSTEMATIC NAME: 1-(2-ethoxyethyl)-3-naphthalen-1-yl-urea
MOLECULAR FORMULA: C15H18N2O2
MOLECULAR WEIGHT: 258.31562
SMILES: CCOCCNC(=O)NC1=CC=CC2=CC=CC=C21
Structure:
CAS RN: 10269-62-2
CAS Name: 1-(2-methoxyethyl)-3-(1-naphthalenyl)urea
OPENEYE Name: 1-(2-methoxyethyl)-3-(1-naphthyl)urea
IUPAC Name: 1-(2-methoxyethyl)-3-naphthalen-1-ylurea
SYSTEMATIC NAME: 1-(2-methoxyethyl)-3-naphthalen-1-yl-urea
MOLECULAR FORMULA: C14H16N2O2
MOLECULAR WEIGHT: 244.28904
SMILES: COCCNC(=O)NC1=CC=CC2=CC=CC=C21
Structure:
CAS RN: 10270-27-6
CAS Name: 1-(3-methoxypropyl)-3-(1-naphthalenyl)urea
OPENEYE Name: 1-(3-methoxypropyl)-3-(1-naphthyl)urea
IUPAC Name: 1-(3-methoxypropyl)-3-naphthalen-1-ylurea
SYSTEMATIC NAME: 1-(3-methoxypropyl)-3-naphthalen-1-yl-urea
MOLECULAR FORMULA: C15H18N2O2
MOLECULAR WEIGHT: 258.31562
SMILES: COCCCNC(=O)NC1=CC=CC2=CC=CC=C21
Structure:
CAS RN: 60075-23-2
CAS Name: 2-(3,4-dimethoxyphenyl)acetohydrazide
OPENEYE Name: 2-(3,4-dimethoxyphenyl)acetohydrazide
IUPAC Name: 2-(3,4-dimethoxyphenyl)acetohydrazide
SYSTEMATIC NAME: 2-(3,4-dimethoxyphenyl)ethanehydrazide
MOLECULAR FORMULA: C10H14N2O3
MOLECULAR WEIGHT: 210.22976
SMILES: COC1=C(C=C(C=C1)CC(=O)NN)OC
Structure:
CAS RN: 31088-06-9
CAS Name: hexadecanoic acid [5-(4-amino-2-oxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methyl ester
OPENEYE Name: [5-(4-amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hexadecanoate
IUPAC Name: [5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hexadecanoate
SYSTEMATIC NAME: [5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl hexadecanoate
MOLECULAR FORMULA: C25H43N3O6
MOLECULAR WEIGHT: 481.62542
SMILES: CCCCCCCCCCCCCCCC(=O)OCC1C(C(C(O1)N2C=CC(=NC2=O)N)O)O
Structure:
CAS RN: 7150-43-8
CAS Name: 1,3-diphenyl-1,3-dihydroisobenzofuran
OPENEYE Name: 1,3-diphenyl-1,3-dihydroisobenzofuran
IUPAC Name: 1,3-diphenyl-1,3-dihydro-2-benzofuran
SYSTEMATIC NAME: 1,3-diphenyl-1,3-dihydro-2-benzofuran
MOLECULAR FORMULA: C20H16O
MOLECULAR WEIGHT: 272.34044
SMILES: C1=CC=C(C=C1)C2C3=CC=CC=C3C(O2)C4=CC=CC=C4
Structure:
CAS RN: 16587-39-6
CAS Name: 1,3-diphenyl-2-benzothiophene
OPENEYE Name: 1,3-diphenyl-2-benzothiophene
IUPAC Name: 1,3-diphenyl-2-benzothiophene
SYSTEMATIC NAME: 1,3-diphenyl-2-benzothiophene
MOLECULAR FORMULA: C20H14S
MOLECULAR WEIGHT: 286.39016
SMILES: C1=CC=C(C=C1)C2=C3C=CC=CC3=C(S2)C4=CC=CC=C4
Structure:
CAS RN: 1666-85-9
CAS Name: 1,3-diphenyl-2-benzothiophene
OPENEYE Name: 1,3-diphenyl-2-benzothiophene
IUPAC Name: 1,3-diphenyl-2-benzothiophene
SYSTEMATIC NAME: 1,3-diphenyl-2-benzothiophene
MOLECULAR FORMULA: C20H14S
MOLECULAR WEIGHT: 286.39016
SMILES: C1=CC=C(C=C1)C2=C3C=CC=CC3=C(S2)C4=CC=CC=C4
Structure:
CAS RN: 2070-08-8
CAS Name: 3-(4-fluorophenyl)-3-methyl-1-benzo[g]isobenzofuranone
OPENEYE Name: 3-(4-fluorophenyl)-3-methyl-benzo[g]isobenzofuran-1-one
IUPAC Name: 3-(4-fluorophenyl)-3-methylbenzo[g][2]benzofuran-1-one
SYSTEMATIC NAME: 3-(4-fluorophenyl)-3-methyl-benzo[g][2]benzofuran-1-one
MOLECULAR FORMULA: C19H13FO2
MOLECULAR WEIGHT: 292.303723
SMILES: CC1(C2=C(C3=CC=CC=C3C=C2)C(=O)O1)C4=CC=C(C=C4)F
Structure:
CAS RN: 54025-76-2
CAS Name: 5-methoxy-8-methyl-3,4-dihydro-2H-naphthalen-1-one
OPENEYE Name: 5-methoxy-8-methyl-tetralin-1-one
IUPAC Name: 5-methoxy-8-methyl-3,4-dihydro-2H-naphthalen-1-one
SYSTEMATIC NAME: 5-methoxy-8-methyl-3,4-dihydro-2H-naphthalen-1-one
MOLECULAR FORMULA: C12H14O2
MOLECULAR WEIGHT: 190.23836
SMILES: CC1=C2C(=C(C=C1)OC)CCCC2=O
Structure:
CAS RN: 52730-11-7
CAS Name: 2-(2-phenylpropan-2-yl)propanedioic acid
OPENEYE Name: 2-(1-methyl-1-phenyl-ethyl)propanedioic acid
IUPAC Name: 2-(2-phenylpropan-2-yl)propanedioic acid
SYSTEMATIC NAME: 2-(2-phenylpropan-2-yl)propanedioic acid
MOLECULAR FORMULA: C12H14O4
MOLECULAR WEIGHT: 222.23716
SMILES: CC(C)(C1=CC=CC=C1)C(C(=O)O)C(=O)O
Structure:
CAS RN: 5721-97-1
CAS Name: [dichloro-(1-phenylcyclopropyl)methyl]benzene
OPENEYE Name: [dichloro-(1-phenylcyclopropyl)methyl]benzene
IUPAC Name: [dichloro-(1-phenylcyclopropyl)methyl]benzene
SYSTEMATIC NAME: [bis(chloranyl)-(1-phenylcyclopropyl)methyl]benzene
MOLECULAR FORMULA: C16H14Cl2
MOLECULAR WEIGHT: 277.18836
SMILES: C1CC1(C2=CC=CC=C2)C(C3=CC=CC=C3)(Cl)Cl
Structure:
CAS RN: 96304-69-7
CAS Name: (2-bromophenyl)-(1-naphthalenyl)methanone
OPENEYE Name: (2-bromophenyl)-(1-naphthyl)methanone
IUPAC Name: (2-bromophenyl)-naphthalen-1-ylmethanone
SYSTEMATIC NAME: (2-bromophenyl)-naphthalen-1-yl-methanone
MOLECULAR FORMULA: C17H11BrO
MOLECULAR WEIGHT: 311.17264
SMILES: C1=CC=C2C(=C1)C=CC=C2C(=O)C3=CC=CC=C3Br
Structure:
CAS RN: 17371-59-4
CAS Name: 2-methyl-3-[(2-methyl-1H-indol-3-yl)-phenylmethyl]-1H-indole
OPENEYE Name: 2-methyl-3-[(2-methyl-1H-indol-3-yl)-phenyl-methyl]-1H-indole
IUPAC Name: 2-methyl-3-[(2-methyl-1H-indol-3-yl)-phenylmethyl]-1H-indole
SYSTEMATIC NAME: 2-methyl-3-[(2-methyl-1H-indol-3-yl)-phenyl-methyl]-1H-indole
MOLECULAR FORMULA: C25H22N2
MOLECULAR WEIGHT: 350.45558
SMILES: CC1=C(C2=CC=CC=C2N1)C(C3=CC=CC=C3)C4=C(NC5=CC=CC=C54)C
Structure:
CAS RN: 31416-83-8
CAS Name: 1-propan-2-yl-2-azetidinecarboxylic acid
OPENEYE Name: 1-isopropylazetidine-2-carboxylic acid
IUPAC Name: 1-propan-2-ylazetidine-2-carboxylic acid
SYSTEMATIC NAME: 1-propan-2-ylazetidine-2-carboxylic acid
MOLECULAR FORMULA: C7H13NO2
MOLECULAR WEIGHT: 143.18362
SMILES: CC(C)N1CCC1C(=O)O
Structure:
CAS RN: 18085-39-7
CAS Name: 1-cyclohexyl-2-azetidinecarboxylic acid
OPENEYE Name: 1-cyclohexylazetidine-2-carboxylic acid
IUPAC Name: 1-cyclohexylazetidine-2-carboxylic acid
SYSTEMATIC NAME: 1-cyclohexylazetidine-2-carboxylic acid
MOLECULAR FORMULA: C10H17NO2
MOLECULAR WEIGHT: 183.24748
SMILES: C1CCC(CC1)N2CCC2C(=O)O
Structure:
CAS RN: 31501-01-6
CAS Name: (1-tert-butyl-2-azetidinyl)methanamine
OPENEYE Name: (1-tert-butylazetidin-2-yl)methanamine
IUPAC Name: (1-tert-butylazetidin-2-yl)methanamine
SYSTEMATIC NAME: (1-tert-butylazetidin-2-yl)methanamine
MOLECULAR FORMULA: C8H18N2
MOLECULAR WEIGHT: 142.24192
SMILES: CC(C)(C)N1CCC1CN
Structure:
CAS RN: 31414-54-7
CAS Name: (1-tert-butyl-2-azetidinyl)methanol
OPENEYE Name: (1-tert-butylazetidin-2-yl)methanol
IUPAC Name: (1-tert-butylazetidin-2-yl)methanol
SYSTEMATIC NAME: (1-tert-butylazetidin-2-yl)methanol
MOLECULAR FORMULA: C8H17NO
MOLECULAR WEIGHT: 143.22668
SMILES: CC(C)(C)N1CCC1CO
Structure:
CAS RN: 24749-04-0
CAS Name: 1,3-diphenyl-2,3-dihydro-1H-benzo[f][1,3]benzoxazine
OPENEYE Name: 1,3-diphenyl-2,3-dihydro-1H-benzo[f][1,3]benzoxazine
IUPAC Name: 1,3-diphenyl-2,3-dihydro-1H-benzo[f][1,3]benzoxazine
SYSTEMATIC NAME: 1,3-diphenyl-2,3-dihydro-1H-benzo[f][1,3]benzoxazine
MOLECULAR FORMULA: C24H19NO
MOLECULAR WEIGHT: 337.41376
SMILES: C1=CC=C(C=C1)C2C3=C(C=CC4=CC=CC=C43)OC(N2)C5=CC=CC=C5
Structure:
CAS RN: 40754-99-2
CAS Name: 2-(1-oxo-2,3,4,9-tetrahydrocarbazol-3-yl)acetonitrile
OPENEYE Name: 2-(1-oxo-2,3,4,9-tetrahydrocarbazol-3-yl)acetonitrile
IUPAC Name: 2-(1-oxo-2,3,4,9-tetrahydrocarbazol-3-yl)acetonitrile
SYSTEMATIC NAME: 2-(1-oxidanylidene-2,3,4,9-tetrahydrocarbazol-3-yl)ethanenitrile
MOLECULAR FORMULA: C14H12N2O
MOLECULAR WEIGHT: 224.25788
SMILES: C1C(CC(=O)C2=C1C3=CC=CC=C3N2)CC#N
Structure:
CAS RN: 40754-98-1
CAS Name: (6-hydroxy-4-azabicyclo[3.3.1]nonan-4-yl)-phenylmethanone
OPENEYE Name: (6-hydroxy-4-azabicyclo[3.3.1]nonan-4-yl)-phenyl-methanone
IUPAC Name: (6-hydroxy-4-azabicyclo[3.3.1]nonan-4-yl)-phenylmethanone
SYSTEMATIC NAME: (6-oxidanyl-4-azabicyclo[3.3.1]nonan-4-yl)-phenyl-methanone
MOLECULAR FORMULA: C15H19NO2
MOLECULAR WEIGHT: 245.31686
SMILES: C1CC(C2CC1CCN2C(=O)C3=CC=CC=C3)O
Structure:
CAS RN: 40755-02-0
CAS Name: 4-methylbenzenesulfonic acid (1-oxo-2,3,4,9-tetrahydrocarbazol-3-yl)methyl ester
OPENEYE Name: (1-oxo-2,3,4,9-tetrahydrocarbazol-3-yl)methyl 4-methylbenzenesulfonate
IUPAC Name: (1-oxo-2,3,4,9-tetrahydrocarbazol-3-yl)methyl 4-methylbenzenesulfonate
SYSTEMATIC NAME: (1-oxidanylidene-2,3,4,9-tetrahydrocarbazol-3-yl)methyl 4-methylbenzenesulfonate
MOLECULAR FORMULA: C20H19NO4S
MOLECULAR WEIGHT: 369.43416
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC2CC3=C(C(=O)C2)NC4=CC=CC=C34
Structure:
CAS RN: 33446-90-1
CAS Name: (2-hydroxy-4-methoxyphenyl)-(4-hydroxyphenyl)methanone
OPENEYE Name: (2-hydroxy-4-methoxy-phenyl)-(4-hydroxyphenyl)methanone
IUPAC Name: (2-hydroxy-4-methoxyphenyl)-(4-hydroxyphenyl)methanone
SYSTEMATIC NAME: (4-hydroxyphenyl)-(4-methoxy-2-oxidanyl-phenyl)methanone
MOLECULAR FORMULA: C14H12O4
MOLECULAR WEIGHT: 244.24268
SMILES: COC1=CC(=C(C=C1)C(=O)C2=CC=C(C=C2)O)O
Structure:
CAS RN: 33021-76-0
CAS Name: (2-bromo-1-phenylcyclopropyl)benzene
OPENEYE Name: (2-bromo-1-phenyl-cyclopropyl)benzene
IUPAC Name: (2-bromo-1-phenylcyclopropyl)benzene
SYSTEMATIC NAME: (2-bromanyl-1-phenyl-cyclopropyl)benzene
MOLECULAR FORMULA: C15H13Br
MOLECULAR WEIGHT: 273.16772
SMILES: C1C(C1(C2=CC=CC=C2)C3=CC=CC=C3)Br
Structure:
CAS RN: 55837-21-3
CAS Name: 1-(4-chlorophenyl)-3-(1H-1,2,4-triazol-5-yl)urea
OPENEYE Name: 1-(4-chlorophenyl)-3-(1H-1,2,4-triazol-5-yl)urea
IUPAC Name: 1-(4-chlorophenyl)-3-(1H-1,2,4-triazol-5-yl)urea
SYSTEMATIC NAME: 1-(4-chlorophenyl)-3-(1H-1,2,4-triazol-5-yl)urea
MOLECULAR FORMULA: C9H8ClN5O
MOLECULAR WEIGHT: 237.64572
SMILES: C1=CC(=CC=C1NC(=O)NC2=NC=NN2)Cl
Structure:
CAS RN: 4029-68-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C26H34O6
MOLECULAR WEIGHT: 442.54456
SMILES: CC(=O)OC1CCC2(C3CCC4(C(CC5C4(C3CCC2(C1)O)O5)C6=COC(=O)C=C6)C)C
Structure:
CAS RN: 52722-61-9
CAS Name: 2-(1-hydroxy-3,4-dioxo-2-naphthalenyl)acetaldehyde
OPENEYE Name: 2-(1-hydroxy-3,4-dioxo-2-naphthyl)acetaldehyde
IUPAC Name: 2-(1-hydroxy-3,4-dioxonaphthalen-2-yl)acetaldehyde
SYSTEMATIC NAME: 2-[1-oxidanyl-3,4-bis(oxidanylidene)naphthalen-2-yl]ethanal
MOLECULAR FORMULA: C12H8O4
MOLECULAR WEIGHT: 216.18952
SMILES: C1=CC=C2C(=C1)C(=C(C(=O)C2=O)CC=O)O
Structure:
CAS RN: 28445-09-2
CAS Name: 3-(3,4,5-trihydroxy-2-oxanyl)-2H-triazolo[4,5-d]pyrimidin-7-one
OPENEYE Name: 3-(3,4,5-trihydroxytetrahydropyran-2-yl)-2H-triazolo[4,5-d]pyrimidin-7-one
IUPAC Name: 3-(3,4,5-trihydroxyoxan-2-yl)-2H-triazolo[4,5-d]pyrimidin-7-one
SYSTEMATIC NAME: 3-[3,4,5-tris(oxidanyl)oxan-2-yl]-2H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
MOLECULAR FORMULA: C9H11N5O5
MOLECULAR WEIGHT: 269.21414
SMILES: C1C(C(C(C(O1)N2C3=NC=NC(=O)C3=NN2)O)O)O
Structure:
CAS RN: 57934-39-1
CAS Name: 9-chloro-12-methoxy-13H-naphtho[2,3-c]acridine-5,8,14-trione
OPENEYE Name: 9-chloro-12-methoxy-13H-naphtho[2,3-c]acridine-5,8,14-trione
IUPAC Name: 9-chloro-12-methoxy-13H-naphtho[2,3-c]acridine-5,8,14-trione
SYSTEMATIC NAME: 9-chloranyl-12-methoxy-13H-naphtho[2,3-c]acridine-5,8,14-trione
MOLECULAR FORMULA: C22H12ClNO4
MOLECULAR WEIGHT: 389.78798
SMILES: COC1=C2C(=C(C=C1)Cl)C(=O)C3=C(N2)C4=C(C=C3)C(=O)C5=CC=CC=C5C4=O
Structure:
CAS RN: 67676-47-5
CAS Name: 4-[ethyl-(phenylmethyl)amino]benzaldehyde
OPENEYE Name: 4-[benzyl(ethyl)amino]benzaldehyde
IUPAC Name: 4-[benzyl(ethyl)amino]benzaldehyde
SYSTEMATIC NAME: 4-[ethyl-(phenylmethyl)amino]benzaldehyde
MOLECULAR FORMULA: C16H17NO
MOLECULAR WEIGHT: 239.31228
SMILES: CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C=O
Structure:
CAS RN: 64824-52-8
CAS Name: 1,1-dioxo-3,5-diphenyl-4-thianone
OPENEYE Name: 1,1-dioxo-3,5-diphenyl-thian-4-one
IUPAC Name: 1,1-dioxo-3,5-diphenylthian-4-one
SYSTEMATIC NAME: 1,1-bis(oxidanylidene)-3,5-diphenyl-thian-4-one
MOLECULAR FORMULA: C17H16O3S
MOLECULAR WEIGHT: 300.37214
SMILES: C1C(C(=O)C(CS1(=O)=O)C2=CC=CC=C2)C3=CC=CC=C3
Structure:
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