CAS RN: 57498-88-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H26O9
MOLECULAR WEIGHT: 434.43644
SMILES: C/C=C(\COC(=O)C)/C(=O)OC1CC2(C(O2)C3C(O3)/C(=C/C4C1C(=C)C(=O)O4)/CO)C
Structure:
CAS RN: 49776-54-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H24O7
MOLECULAR WEIGHT: 376.40036
SMILES: C/C=C(\CO)/C(=O)OC1CC2(C(O2)/C=C\C(=C\C3C1C(=C)C(=O)O3)\CO)C
Structure:
CAS RN: 78993-84-7
CAS Name: (5Z)-2-methyl-3-phenyl-5-(phenylmethylene)-4-imidazolone
OPENEYE Name: (5Z)-5-benzylidene-2-methyl-3-phenyl-imidazol-4-one
IUPAC Name: (5Z)-5-benzylidene-2-methyl-3-phenylimidazol-4-one
SYSTEMATIC NAME: (5Z)-2-methyl-3-phenyl-5-(phenylmethylidene)imidazol-4-one
MOLECULAR FORMULA: C17H14N2O
MOLECULAR WEIGHT: 262.30586
SMILES: CC1=N/C(=C\C2=CC=CC=C2)/C(=O)N1C3=CC=CC=C3
Structure:
CAS RN: 81905-05-7
CAS Name: (4Z)-4-(anilinomethylidene)-3-methyl-1H-pyrazol-5-one
OPENEYE Name: (4Z)-4-(anilinomethylene)-3-methyl-1H-pyrazol-5-one
IUPAC Name: (4Z)-4-(anilinomethylidene)-3-methyl-1H-pyrazol-5-one
SYSTEMATIC NAME: (4Z)-3-methyl-4-(phenylazanylmethylidene)-1H-pyrazol-5-one
MOLECULAR FORMULA: C11H11N3O
MOLECULAR WEIGHT: 201.22454
SMILES: CC\1=NNC(=O)/C1=C\NC2=CC=CC=C2
Structure:
CAS RN: 95897-98-6
CAS Name: (E)-3-[[6-[(3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-3-hydroxy-2-methyl-4-oxanyl]amino]-2-butenoic acid ethyl ester
OPENEYE Name: ethyl (E)-3-[[6-[(3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-3-hydroxy-2-methyl-tetrahydropyran-4-yl]amino]but-2-enoate
IUPAC Name: ethyl (E)-3-[[6-[(3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl)oxy]-3-hydroxy-2-methyloxan-4-yl]amino]but-2-enoate
SYSTEMATIC NAME: ethyl (E)-3-[[6-[[3-ethanoyl-10-methoxy-3,5,12-tris(oxidanyl)-6,11-bis(oxidanylidene)-2,4-dihydro-1H-tetracen-1-yl]oxy]-2-methyl-3-oxidanyl-oxan-4-yl]amino]but-2-enoate
MOLECULAR FORMULA: C33H37NO12
MOLECULAR WEIGHT: 639.64638
SMILES: CCOC(=O)/C=C(\C)/NC1CC(OC(C1O)C)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)C)O
Structure:
CAS RN: 86902-36-5
CAS Name: (2E)-2-(trimethylsilyloxymethylidene)-3,4-dihydronaphthalen-1-one
OPENEYE Name: (2E)-2-(trimethylsilyloxymethylene)tetralin-1-one
IUPAC Name: (2E)-2-(trimethylsilyloxymethylidene)-3,4-dihydronaphthalen-1-one
SYSTEMATIC NAME: (2E)-2-(trimethylsilyloxymethylidene)-3,4-dihydronaphthalen-1-one
MOLECULAR FORMULA: C14H18O2Si
MOLECULAR WEIGHT: 246.37702
SMILES: C[Si](C)(C)O/C=C/1\CCC2=CC=CC=C2C1=O
Structure:
CAS RN: 79553-45-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C47H80O16
MOLECULAR WEIGHT: 901.1285
SMILES: CCC(CC1C(CCC2(O1)CC3C(C(O2)CC4(C(CC(CO4)C)/C=C/CCCC(C(C(C(C(C(C(/C=C\C(=O)O3)(C)O)O)C)O)OC5CC(C(C(O5)C)O)OC)O)(C)O)O)C)C)O
Structure:
CAS RN: 70709-62-5
CAS Name: 5-[(2E)-2-[2-anilino-1-(2-methoxy-4-nitro-5-sulfophenyl)azo-2-oxoethylidene]hydrazinyl]-4-methoxy-2-nitrobenzenesulfonic acid
OPENEYE Name: 5-[(2E)-2-[2-anilino-1-(2-methoxy-4-nitro-5-sulfo-phenyl)azo-2-oxo-ethylidene]hydrazino]-4-methoxy-2-nitro-benzenesulfonic acid
IUPAC Name: 5-[(2E)-2-[2-anilino-1-[(2-methoxy-4-nitro-5-sulfophenyl)diazenyl]-2-oxoethylidene]hydrazinyl]-4-methoxy-2-nitrobenzenesulfonic acid
SYSTEMATIC NAME: 4-methoxy-5-[(2E)-2-[1-[(2-methoxy-4-nitro-5-sulfo-phenyl)diazenyl]-2-oxidanylidene-2-phenylazanyl-ethylidene]hydrazinyl]-2-nitro-benzenesulfonic acid
MOLECULAR FORMULA: C22H19N7O13S2
MOLECULAR WEIGHT: 653.55536
SMILES: COC1=CC(=C(C=C1N/N=C(\C(=O)NC2=CC=CC=C2)/N=NC3=CC(=C(C=C3OC)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O)[N+](=O)[O-]
Structure:
CAS RN: 93860-23-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C29H36O9
MOLECULAR WEIGHT: 528.59074
SMILES: CC1=CC2C3(CC1)COC(=O)/C=C\4/CCOC(C4O)(/C=C\C=C/C(=O)OC5C3(C6(CO6)C(C5)O2)C)C(C)O
Structure:
CAS RN: 71555-54-9
CAS Name: 4-(2-pyridinyl)-N-[(Z)-1-(2-pyridinyl)ethylideneamino]-1-piperazinecarbothioamide
OPENEYE Name: 4-(2-pyridyl)-N-[(Z)-1-(2-pyridyl)ethylideneamino]piperazine-1-carbothioamide
IUPAC Name: 4-pyridin-2-yl-N-[(Z)-1-pyridin-2-ylethylideneamino]piperazine-1-carbothioamide
SYSTEMATIC NAME: 4-pyridin-2-yl-N-[(Z)-1-pyridin-2-ylethylideneamino]piperazine-1-carbothioamide
MOLECULAR FORMULA: C17H20N6S
MOLECULAR WEIGHT: 340.4459
SMILES: C/C(=N/NC(=S)N1CCN(CC1)C2=CC=CC=N2)/C3=CC=CC=N3
Structure:
CAS RN: 79101-55-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C36H48ClN3O12
MOLECULAR WEIGHT: 750.23222
SMILES: CC1C2CC(C(/C=C\C=C(/C(C3=CC(=C(C(=C3)OC)Cl)N4CCC(C(=O)NC(C(=O)OC(CC4=O)C5(C1O5)C)C)(C)O)OC)\C)OC)(NC(=O)O2)O
Structure:
CAS RN: 78987-28-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C36H50ClN3O11
MOLECULAR WEIGHT: 736.2487
SMILES: CC1C2CC(C(/C=C/C=C(/C(C3=CC(=C(C(=C3)OC)Cl)N(C(=O)CC(C4(C1O4)C)OC(=O)C(C)NC(=O)C(C)C)C)OC)\C)OC)(NC(=O)O2)O
Structure:
CAS RN: 78987-27-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C37H50ClN3O11
MOLECULAR WEIGHT: 748.2594
SMILES: CC1C2CC(C(/C=C/C=C(/C(C3=CC(=C(C(=C3)OC)Cl)N(C(=O)CC(C4(C1O4)C)OC(=O)C(C)N(C)C(=O)C(=C)C)C)OC)\C)OC)(NC(=O)O2)O
Structure:
CAS RN: 58523-30-1
CAS Name: 2-benzoyl-8-[(E)-1,2-dihydroxyhex-3-enyl]-1-hydroxy-2-methoxy-7-methyl-9-oxa-3-azaspiro[4.4]non-7-ene-4,6-dione
OPENEYE Name: 2-benzoyl-8-[(E)-1,2-dihydroxyhex-3-enyl]-1-hydroxy-2-methoxy-7-methyl-9-oxa-3-azaspiro[4.4]non-7-ene-4,6-dione
IUPAC Name: 2-benzoyl-8-[(E)-1,2-dihydroxyhex-3-enyl]-1-hydroxy-2-methoxy-7-methyl-9-oxa-3-azaspiro[4.4]non-7-ene-4,6-dione
SYSTEMATIC NAME: 8-[(E)-1,2-bis(oxidanyl)hex-3-enyl]-2-methoxy-7-methyl-1-oxidanyl-2-(phenylcarbonyl)-9-oxa-3-azaspiro[4.4]non-7-ene-4,6-dione
MOLECULAR FORMULA: C22H25NO8
MOLECULAR WEIGHT: 431.4358
SMILES: CC/C=C/C(C(C1=C(C(=O)C2(O1)C(C(NC2=O)(C(=O)C3=CC=CC=C3)OC)O)C)O)O
Structure:
CAS RN: 86825-99-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C38H50O16
MOLECULAR WEIGHT: 762.794
SMILES: CC1COC2(CC1OC(=O)/C=C/C3=CC=CC=C3)C4(CO4)C5CCC(CC5O2)C(=O)OC6C(C(C(C(O6)C)OC(=O)C)O)OC7C(C(C(C(O7)C)O)O)O
Structure:
CAS RN: 62955-96-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C46H58O20
MOLECULAR WEIGHT: 930.94072
SMILES: CC1COC2(CC1OC(=O)/C=C/C3=CC=CC=C3)C4(CO4)C5CCC(CC5O2)C(=O)OC6C(C(C(C(O6)C)OC(=O)C)OC(=O)C)OC7C(C(C(C(O7)C)OC(=O)C)OC(=O)C)OC(=O)C
Structure:
CAS RN: 62948-37-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C25H30O7
MOLECULAR WEIGHT: 442.5015
SMILES: CC1COC2(CC1OC(=O)/C=C/C3=CC=CC=C3)C4(CO4)C5CCC(CC5O2)C(=O)OC
Structure:
CAS RN: 81026-38-2
CAS Name: (6Z,10Z,14E)-6,14-dimethyl-3-methylene-2-oxo-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-10-carboxylic acid
OPENEYE Name: (6Z,10Z,14E)-6,14-dimethyl-3-methylene-2-oxo-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-10-carboxylic acid
IUPAC Name: (6Z,10Z,14E)-6,14-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-10-carboxylic acid
SYSTEMATIC NAME: (6Z,10Z,14E)-6,14-dimethyl-3-methylidene-2-oxidanylidene-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-10-carboxylic acid
MOLECULAR FORMULA: C20H26O4
MOLECULAR WEIGHT: 330.41804
SMILES: C/C/1=C/CC/C(=C/CC/C(=C/C2C(CC1)C(=C)C(=O)O2)/C)/C(=O)O
Structure:
CAS RN: 61444-94-8
CAS Name: (5Z)-5-(nitrosomethylidene)-2H-thiadiazole
OPENEYE Name: (5Z)-5-(nitrosomethylene)-2H-thiadiazole
IUPAC Name: (5Z)-5-(nitrosomethylidene)-2H-thiadiazole
SYSTEMATIC NAME: (5Z)-5-(nitrosomethylidene)-2H-1,2,3-thiadiazole
MOLECULAR FORMULA: C3H3N3OS
MOLECULAR WEIGHT: 129.14042
SMILES: C\1=NNS/C1=C\N=O
Structure:
CAS RN: 16013-92-6
CAS Name: 6-(2-aminoethylamino)-1,2,3,4-tetrahydronaphtho[3,2-f]quinoxaline-7,12-dione
OPENEYE Name: 6-(2-aminoethylamino)-1,2,3,4-tetrahydronaphtho[3,2-f]quinoxaline-7,12-dione
IUPAC Name: 6-(2-aminoethylamino)-1,2,3,4-tetrahydronaphtho[3,2-f]quinoxaline-7,12-dione
SYSTEMATIC NAME: 6-(2-azanylethylamino)-1,2,3,4-tetrahydronaphtho[3,2-f]quinoxaline-7,12-dione
MOLECULAR FORMULA: C18H18N4O2
MOLECULAR WEIGHT: 322.36112
SMILES: C1CNC2=C3C(=C(C=C2N1)NCCN)C(=O)C4=CC=CC=C4C3=O
Structure:
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