CAS RN: 87756-40-9
CAS Name: 1-(3,8,8-trimethyl-6,7-dihydro-5H-naphthalen-2-yl)ethanone
OPENEYE Name: 1-(4,4,7-trimethyltetralin-6-yl)ethanone
IUPAC Name: 1-(3,8,8-trimethyl-6,7-dihydro-5H-naphthalen-2-yl)ethanone
SYSTEMATIC NAME: 1-(3,8,8-trimethyl-6,7-dihydro-5H-naphthalen-2-yl)ethanone
MOLECULAR FORMULA: C15H20O
MOLECULAR WEIGHT: 216.3187
SMILES: CC1=CC2=C(C=C1C(=O)C)C(CCC2)(C)C
Structure:
CAS RN: 87745-18-4
CAS Name: 5,5,5-trideuterio-2-(3,3,3-trideuteriopropyl)pentanoic acid
OPENEYE Name: 5,5,5-trideuterio-2-(3,3,3-trideuteriopropyl)pentanoic acid
IUPAC Name: 5,5,5-trideuterio-2-(3,3,3-trideuteriopropyl)pentanoic acid
SYSTEMATIC NAME: 5,5,5-trideuterio-2-(3,3,3-trideuteriopropyl)pentanoic acid
MOLECULAR FORMULA: C8H16O2
MOLECULAR WEIGHT: 150.248411
SMILES: [2H]C([2H])([2H])CCC(CCC([2H])([2H])[2H])C(=O)O
Structure:
CAS RN: 87709-19-1
CAS Name: 1-(dimethoxyphosphorylthio)-1-hexyne
OPENEYE Name: 1-dimethoxyphosphorylsulfanylhex-1-yne
IUPAC Name: 1-dimethoxyphosphorylsulfanylhex-1-yne
SYSTEMATIC NAME: 1-dimethoxyphosphorylsulfanylhex-1-yne
MOLECULAR FORMULA: C8H15O3PS
MOLECULAR WEIGHT: 222.241661
SMILES: CCCCC#CSP(=O)(OC)OC
Structure:
CAS RN: 87709-18-0
CAS Name: 1-(dimethoxyphosphorylthio)-3-(ethylthio)-1-propyne
OPENEYE Name: 1-dimethoxyphosphorylsulfanyl-3-ethylsulfanyl-prop-1-yne
IUPAC Name: 1-dimethoxyphosphorylsulfanyl-3-ethylsulfanylprop-1-yne
SYSTEMATIC NAME: 1-dimethoxyphosphorylsulfanyl-3-ethylsulfanyl-prop-1-yne
MOLECULAR FORMULA: C7H13O3PS2
MOLECULAR WEIGHT: 240.280081
SMILES: CCSCC#CSP(=O)(OC)OC
Structure:
CAS RN: 87709-17-9
CAS Name: 2-(diethoxyphosphorylthio)ethynylbenzene
OPENEYE Name: 2-diethoxyphosphorylsulfanylethynylbenzene
IUPAC Name: 2-diethoxyphosphorylsulfanylethynylbenzene
SYSTEMATIC NAME: 2-diethoxyphosphorylsulfanylethynylbenzene
MOLECULAR FORMULA: C12H15O3PS
MOLECULAR WEIGHT: 270.284461
SMILES: CCOP(=O)(OCC)SC#CC1=CC=CC=C1
Structure:
CAS RN: 87709-16-8
CAS Name: acetic acid 3-(diethoxyphosphorylthio)prop-2-ynyl ester
OPENEYE Name: 3-diethoxyphosphorylsulfanylprop-2-ynyl acetate
IUPAC Name: 3-diethoxyphosphorylsulfanylprop-2-ynyl acetate
SYSTEMATIC NAME: 3-diethoxyphosphorylsulfanylprop-2-ynyl ethanoate
MOLECULAR FORMULA: C9H15O5PS
MOLECULAR WEIGHT: 266.251161
SMILES: CCOP(=O)(OCC)SC#CCOC(=O)C
Structure:
CAS RN: 87709-12-4
CAS Name: 1-[3-(diethoxyphosphorylthio)prop-2-ynylthio]butane
OPENEYE Name: 1-(3-diethoxyphosphorylsulfanylprop-2-ynylsulfanyl)butane
IUPAC Name: 1-(3-diethoxyphosphorylsulfanylprop-2-ynylsulfanyl)butane
SYSTEMATIC NAME: 1-(3-diethoxyphosphorylsulfanylprop-2-ynylsulfanyl)butane
MOLECULAR FORMULA: C11H21O3PS2
MOLECULAR WEIGHT: 296.386401
SMILES: CCCCSCC#CSP(=O)(OCC)OCC
Structure:
CAS RN: 87707-10-6
CAS Name: 7,8-dihydrobenzo[h]quinoline-7,8-diol
OPENEYE Name: 7,8-dihydrobenzo[h]quinoline-7,8-diol
IUPAC Name: 7,8-dihydrobenzo[h]quinoline-7,8-diol
SYSTEMATIC NAME: 7,8-dihydrobenzo[h]quinoline-7,8-diol
MOLECULAR FORMULA: C13H11NO2
MOLECULAR WEIGHT: 213.23194
SMILES: C1=CC2=C(C3=C(C=C2)C(C(C=C3)O)O)N=C1
Structure:
CAS RN: 87707-08-2
CAS Name: 8-benzo[f]quinolinol
OPENEYE Name: benzo[f]quinolin-8-ol
IUPAC Name: benzo[f]quinolin-8-ol
SYSTEMATIC NAME: benzo[f]quinolin-8-ol
MOLECULAR FORMULA: C13H9NO
MOLECULAR WEIGHT: 195.21666
SMILES: C1=CC2=C(C=CC3=C2C=CC(=C3)O)N=C1
Structure:
CAS RN: 87707-07-1
CAS Name: 5,6-dihydrobenzo[f]quinoline-5,6-diol
OPENEYE Name: 5,6-dihydrobenzo[f]quinoline-5,6-diol
IUPAC Name: 5,6-dihydrobenzo[f]quinoline-5,6-diol
SYSTEMATIC NAME: 5,6-dihydrobenzo[f]quinoline-5,6-diol
MOLECULAR FORMULA: C13H11NO2
MOLECULAR WEIGHT: 213.23194
SMILES: C1=CC=C2C3=C(C(C(C2=C1)O)O)N=CC=C3
Structure:
CAS RN: 87707-06-0
CAS Name: 7,8-dihydrobenzo[f]quinoline-7,8-diol
OPENEYE Name: 7,8-dihydrobenzo[f]quinoline-7,8-diol
IUPAC Name: 7,8-dihydrobenzo[f]quinoline-7,8-diol
SYSTEMATIC NAME: 7,8-dihydrobenzo[f]quinoline-7,8-diol
MOLECULAR FORMULA: C13H11NO2
MOLECULAR WEIGHT: 213.23194
SMILES: C1=CC2=C(C=CC3=C2C=CC(C3O)O)N=C1
Structure:
CAS RN: 87700-15-0
CAS Name: 7-[[(1R,4aS,6S,8aR)-6-hydroxy-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methoxy]-6,8-dimethoxy-1-benzopyran-2-one
OPENEYE Name: 7-[[(1R,4aS,6S,8aR)-6-hydroxy-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methoxy]-6,8-dimethoxy-chromen-2-one
IUPAC Name: 7-[[(1R,4aS,6S,8aR)-6-hydroxy-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methoxy]-6,8-dimethoxychromen-2-one
SYSTEMATIC NAME: 7-[[(1R,4aS,6S,8aR)-2,5,5,8a-tetramethyl-6-oxidanyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methoxy]-6,8-dimethoxy-chromen-2-one
MOLECULAR FORMULA: C26H34O6
MOLECULAR WEIGHT: 442.54456
SMILES: CC1=CC[C@H]2[C@]([C@@H]1COC3=C(C=C4C=CC(=O)OC4=C3OC)OC)(CC[C@@H](C2(C)C)O)C
Structure:
CAS RN: 87688-90-2
CAS Name: 4-prop-2-enyl-2-(4-prop-2-enylphenoxy)phenol
OPENEYE Name: 4-allyl-2-(4-allylphenoxy)phenol
IUPAC Name: 4-prop-2-enyl-2-(4-prop-2-enylphenoxy)phenol
SYSTEMATIC NAME: 4-prop-2-enyl-2-(4-prop-2-enylphenoxy)phenol
MOLECULAR FORMULA: C18H18O2
MOLECULAR WEIGHT: 266.33432
SMILES: C=CCC1=CC=C(C=C1)OC2=C(C=CC(=C2)CC=C)O
Structure:
CAS RN: 87686-79-1
CAS Name: 2-hydroxy-3-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]benzoic acid [(2R,3R,4S,5R,6S)-4-acetyloxy-2-(acetyloxymethyl)-6-[[(3S,4R,4aS)-4-ethenyl-8-oxo-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-3-yl]oxy]-5-benzoyloxy-3-oxanyl] ester
OPENEYE Name: [(2R,3R,4S,5R,6S)-4-acetoxy-2-(acetoxymethyl)-6-[[(3S,4R,4aS)-8-oxo-4-vinyl-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-3-yl]oxy]-5-benzoyloxy-tetrahydropyran-3-yl] 2-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-ben
IUPAC Name: [(2R,3R,4S,5R,6S)-4-acetyloxy-2-(acetyloxymethyl)-6-[[(3S,4R,4aS)-4-ethenyl-8-oxo-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-3-yl]oxy]-5-benzoyloxyoxan-3-yl] 2-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoate
SYSTEMATIC NAME: [(2R,3R,4S,5R,6S)-4-acetyloxy-2-(acetyloxymethyl)-6-[[(3S,4R,4aS)-4-ethenyl-8-oxidanylidene-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-3-yl]oxy]-5-(phenylcarbonyloxy)oxan-3-yl] 3-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2-oxida
MOLECULAR FORMULA: C40H44O20
MOLECULAR WEIGHT: 844.76536
SMILES: CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@H]2[C@@H]([C@@H]3CCOC(=O)C3=CO2)C=C)OC(=O)C4=CC=CC=C4)OC(=O)C)OC(=O)C5=C(C(=CC=C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O
Structure:
CAS RN: 87686-71-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C30H24O10
MOLECULAR WEIGHT: 544.50556
SMILES: C1[C@@H]([C@@H](OC2=CC3=C([C@H]4[C@H]([C@](O3)(OC5=CC(=CC(=C45)O)O)C6=CC=C(C=C6)O)O)C(=C21)O)C7=CC=C(C=C7)O)O
Structure:
CAS RN: 87651-10-3
CAS Name: 6-methyl-7-prop-2-enyl-7H-thieno[2,3-c]pyridine
OPENEYE Name: 7-allyl-6-methyl-7H-thieno[2,3-c]pyridine
IUPAC Name: 6-methyl-7-prop-2-enyl-7H-thieno[2,3-c]pyridine
SYSTEMATIC NAME: 6-methyl-7-prop-2-enyl-7H-thieno[2,3-c]pyridine
MOLECULAR FORMULA: C11H13NS
MOLECULAR WEIGHT: 191.29262
SMILES: CN1C=CC2=C(C1CC=C)SC=C2
Structure:
CAS RN: 87644-24-4
CAS Name: 2-[[[[4-(hydroxymethyl)-6-methoxy-1,3,5-triazin-2-yl]amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester
OPENEYE Name: methyl 2-[[4-(hydroxymethyl)-6-methoxy-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate
IUPAC Name: methyl 2-[[4-(hydroxymethyl)-6-methoxy-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate
SYSTEMATIC NAME: methyl 2-[[4-(hydroxymethyl)-6-methoxy-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate
MOLECULAR FORMULA: C14H15N5O7S
MOLECULAR WEIGHT: 397.3632
SMILES: COC1=NC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)CO
Structure:
CAS RN: 87625-52-3
CAS Name: 5-methoxy-2-(3-methylbutyl)naphthalene-1,4-dione
OPENEYE Name: 2-isopentyl-5-methoxy-naphthalene-1,4-dione
IUPAC Name: 5-methoxy-2-(3-methylbutyl)naphthalene-1,4-dione
SYSTEMATIC NAME: 5-methoxy-2-(3-methylbutyl)naphthalene-1,4-dione
MOLECULAR FORMULA: C16H18O3
MOLECULAR WEIGHT: 258.31232
SMILES: CC(C)CCC1=CC(=O)C2=C(C1=O)C=CC=C2OC
Structure:
CAS RN: 87620-08-4
CAS Name: 1,1,2,2-tetradeuterio-2-phenylethanamine
OPENEYE Name: 1,1,2,2-tetradeuterio-2-phenyl-ethanamine
IUPAC Name: 1,1,2,2-tetradeuterio-2-phenylethanamine
SYSTEMATIC NAME: 1,1,2,2-tetradeuterio-2-phenyl-ethanamine
MOLECULAR FORMULA: C8H11N
MOLECULAR WEIGHT: 125.204287
SMILES: [2H]C([2H])(C1=CC=CC=C1)C([2H])([2H])N
Structure:
CAS RN: 87590-45-2
CAS Name: 5-hexoxy-1,3-benzodioxole
OPENEYE Name: 5-hexoxy-1,3-benzodioxole
IUPAC Name: 5-hexoxy-1,3-benzodioxole
SYSTEMATIC NAME: 5-hexoxy-1,3-benzodioxole
MOLECULAR FORMULA: C13H18O3
MOLECULAR WEIGHT: 222.28022
SMILES: CCCCCCOC1=CC2=C(C=C1)OCO2
Structure:
CAS RN: 87590-44-1
CAS Name: 5-pentoxy-1,3-benzodioxole
OPENEYE Name: 5-pentoxy-1,3-benzodioxole
IUPAC Name: 5-pentoxy-1,3-benzodioxole
SYSTEMATIC NAME: 5-pentoxy-1,3-benzodioxole
MOLECULAR FORMULA: C12H16O3
MOLECULAR WEIGHT: 208.25364
SMILES: CCCCCOC1=CC2=C(C=C1)OCO2
Structure:
CAS RN: 87590-43-0
CAS Name: 5-butoxy-1,3-benzodioxole
OPENEYE Name: 5-butoxy-1,3-benzodioxole
IUPAC Name: 5-butoxy-1,3-benzodioxole
SYSTEMATIC NAME: 5-butoxy-1,3-benzodioxole
MOLECULAR FORMULA: C11H14O3
MOLECULAR WEIGHT: 194.22706
SMILES: CCCCOC1=CC2=C(C=C1)OCO2
Structure:
CAS RN: 87590-42-9
CAS Name: 5-propoxy-1,3-benzodioxole
OPENEYE Name: 5-propoxy-1,3-benzodioxole
IUPAC Name: 5-propoxy-1,3-benzodioxole
SYSTEMATIC NAME: 5-propoxy-1,3-benzodioxole
MOLECULAR FORMULA: C10H12O3
MOLECULAR WEIGHT: 180.20048
SMILES: CCCOC1=CC2=C(C=C1)OCO2
Structure:
CAS RN: 87590-41-8
CAS Name: 5-ethoxy-1,3-benzodioxole
OPENEYE Name: 5-ethoxy-1,3-benzodioxole
IUPAC Name: 5-ethoxy-1,3-benzodioxole
SYSTEMATIC NAME: 5-ethoxy-1,3-benzodioxole
MOLECULAR FORMULA: C9H10O3
MOLECULAR WEIGHT: 166.1739
SMILES: CCOC1=CC2=C(C=C1)OCO2
Structure:
CAS RN: 87585-32-8
CAS Name: (2R,3R,4S,5S,6R)-2-[(1S,3R)-7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-6-(hydroxymethyl)-2-methoxyoxane-3,4,5-triol
OPENEYE Name: (2R,3R,4S,5S,6R)-2-[(1S,3R)-7-hydroxy-1-(4-hydroxy-3,5-dimethoxy-phenyl)-3-(hydroxymethyl)-6,8-dimethoxy-tetralin-2-yl]-6-(hydroxymethyl)-2-methoxy-tetrahydropyran-3,4,5-triol
IUPAC Name: (2R,3R,4S,5S,6R)-2-[(1S,3R)-7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-6-(hydroxymethyl)-2-methoxyoxane-3,4,5-triol
SYSTEMATIC NAME: (2R,3R,4S,5S,6R)-2-[(1S,3R)-1-(3,5-dimethoxy-4-oxidanyl-phenyl)-3-(hydroxymethyl)-6,8-dimethoxy-7-oxidanyl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-(hydroxymethyl)-2-methoxy-oxane-3,4,5-triol
MOLECULAR FORMULA: C28H38O13
MOLECULAR WEIGHT: 582.59352
SMILES: COC1=CC(=CC(=C1O)OC)[C@@H]2C([C@@H](CC3=CC(=C(C(=C23)OC)O)OC)CO)[C@@]4([C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)OC
Structure:
CAS RN: 87579-57-5
CAS Name: 2-[[[ethoxy(methyl)phosphinothioyl]thio]methylthio]acetic acid
OPENEYE Name: 2-[[ethoxy(methyl)phosphinothioyl]sulfanylmethylsulfanyl]acetic acid
IUPAC Name: 2-[[ethoxy(methyl)phosphinothioyl]sulfanylmethylsulfanyl]acetic acid
SYSTEMATIC NAME: 2-[[ethoxy(methyl)phosphinothioyl]sulfanylmethylsulfanyl]ethanoic acid
MOLECULAR FORMULA: C6H13O3PS3
MOLECULAR WEIGHT: 260.334381
SMILES: CCOP(=S)(C)SCSCC(=O)O
Structure:
CAS RN: 87579-56-4
CAS Name: 2-[[[ethoxy(methyl)phosphoryl]thio]methylsulfinyl]acetic acid methyl ester
OPENEYE Name: methyl 2-[[ethoxy(methyl)phosphoryl]sulfanylmethylsulfinyl]acetate
IUPAC Name: methyl 2-[[ethoxy(methyl)phosphoryl]sulfanylmethylsulfinyl]acetate
SYSTEMATIC NAME: methyl 2-[[ethoxy(methyl)phosphoryl]sulfanylmethylsulfinyl]ethanoate
MOLECULAR FORMULA: C7H15O5PS2
MOLECULAR WEIGHT: 274.294761
SMILES: CCOP(=O)(C)SCS(=O)CC(=O)OC
Structure:
CAS RN: 87579-55-3
CAS Name: 2-[[[ethoxy(methyl)phosphinothioyl]thio]methylsulfinyl]acetic acid methyl ester
OPENEYE Name: methyl 2-[[ethoxy(methyl)phosphinothioyl]sulfanylmethylsulfinyl]acetate
IUPAC Name: methyl 2-[[ethoxy(methyl)phosphinothioyl]sulfanylmethylsulfinyl]acetate
SYSTEMATIC NAME: methyl 2-[[ethoxy(methyl)phosphinothioyl]sulfanylmethylsulfinyl]ethanoate
MOLECULAR FORMULA: C7H15O4PS3
MOLECULAR WEIGHT: 290.360361
SMILES: CCOP(=S)(C)SCS(=O)CC(=O)OC
Structure:
CAS RN: 87575-85-7
CAS Name: 2,2,3-trimethyl-10-methylsulfonyl-[1,3,5]triazino[1,2-a]benzimidazol-4-one
OPENEYE Name: 2,2,3-trimethyl-10-methylsulfonyl-[1,3,5]triazino[1,2-a]benzimidazol-4-one
IUPAC Name: 2,2,3-trimethyl-10-methylsulfonyl-[1,3,5]triazino[1,2-a]benzimidazol-4-one
SYSTEMATIC NAME: 2,2,3-trimethyl-10-methylsulfonyl-[1,3,5]triazino[1,2-a]benzimidazol-4-one
MOLECULAR FORMULA: C13H16N4O3S
MOLECULAR WEIGHT: 308.35614
SMILES: CC1(N=C2N(C3=CC=CC=C3N2S(=O)(=O)C)C(=O)N1C)C
Structure:
CAS RN: 87575-76-6
CAS Name: 2,2,3,10-tetramethyl-[1,3,5]triazino[1,2-a]benzimidazol-4-one
OPENEYE Name: 2,2,3,10-tetramethyl-[1,3,5]triazino[1,2-a]benzimidazol-4-one
IUPAC Name: 2,2,3,10-tetramethyl-[1,3,5]triazino[1,2-a]benzimidazol-4-one
SYSTEMATIC NAME: 2,2,3,10-tetramethyl-[1,3,5]triazino[1,2-a]benzimidazol-4-one
MOLECULAR FORMULA: C13H16N4O
MOLECULAR WEIGHT: 244.29234
SMILES: CC1(N=C2N(C3=CC=CC=C3N2C(=O)N1C)C)C
Structure:
CAS RN: 87575-74-4
CAS Name: 10-acetyl-2,2,3-trimethyl-[1,3,5]triazino[1,2-a]benzimidazol-4-one
OPENEYE Name: 10-acetyl-2,2,3-trimethyl-[1,3,5]triazino[1,2-a]benzimidazol-4-one
IUPAC Name: 10-acetyl-2,2,3-trimethyl-[1,3,5]triazino[1,2-a]benzimidazol-4-one
SYSTEMATIC NAME: 10-ethanoyl-2,2,3-trimethyl-[1,3,5]triazino[1,2-a]benzimidazol-4-one
MOLECULAR FORMULA: C14H16N4O2
MOLECULAR WEIGHT: 272.30244
SMILES: CC(=O)N1C2=CC=CC=C2N3C1=NC(N(C3=O)C)(C)C
Structure:
CAS RN: 87575-70-0
CAS Name: 2,2,3-trimethyl-4-oxo-N-propan-2-yl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
OPENEYE Name: N-isopropyl-2,2,3-trimethyl-4-oxo-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
IUPAC Name: 2,2,3-trimethyl-4-oxo-N-propan-2-yl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
SYSTEMATIC NAME: 2,2,3-trimethyl-4-oxidanylidene-N-propan-2-yl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
MOLECULAR FORMULA: C16H21N5O2
MOLECULAR WEIGHT: 315.37024
SMILES: CC(C)NC(=O)N1C2=CC=CC=C2N3C1=NC(N(C3=O)C)(C)C
Structure:
CAS RN: 87575-69-7
CAS Name: 2,2,3-trimethyl-4-oxo-N-propyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
OPENEYE Name: 2,2,3-trimethyl-4-oxo-N-propyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
IUPAC Name: 2,2,3-trimethyl-4-oxo-N-propyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
SYSTEMATIC NAME: 2,2,3-trimethyl-4-oxidanylidene-N-propyl-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
MOLECULAR FORMULA: C16H21N5O2
MOLECULAR WEIGHT: 315.37024
SMILES: CCCNC(=O)N1C2=CC=CC=C2N3C1=NC(N(C3=O)C)(C)C
Structure:
CAS RN: 87575-68-6
CAS Name: N-ethyl-2,2,3-trimethyl-4-oxo-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
OPENEYE Name: N-ethyl-2,2,3-trimethyl-4-oxo-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
IUPAC Name: N-ethyl-2,2,3-trimethyl-4-oxo-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
SYSTEMATIC NAME: N-ethyl-2,2,3-trimethyl-4-oxidanylidene-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
MOLECULAR FORMULA: C15H19N5O2
MOLECULAR WEIGHT: 301.34366
SMILES: CCNC(=O)N1C2=CC=CC=C2N3C1=NC(N(C3=O)C)(C)C
Structure:
CAS RN: 87575-60-8
CAS Name: N,2,2,3-tetramethyl-4-oxo-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
OPENEYE Name: N,2,2,3-tetramethyl-4-oxo-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
IUPAC Name: N,2,2,3-tetramethyl-4-oxo-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
SYSTEMATIC NAME: N,2,2,3-tetramethyl-4-oxidanylidene-[1,3,5]triazino[1,2-a]benzimidazole-10-carboxamide
MOLECULAR FORMULA: C14H17N5O2
MOLECULAR WEIGHT: 287.31708
SMILES: CC1(N=C2N(C3=CC=CC=C3N2C(=O)NC)C(=O)N1C)C
Structure:
CAS RN: 87553-46-6
CAS Name: (2R,4aS,4bS,8aS)-2,4b,8,8-tetramethyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthren-2-ol
OPENEYE Name: (2R,4aS,4bS,8aS)-2,4b,8,8-tetramethyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthren-2-ol
IUPAC Name: (2R,4aS,4bS,8aS)-2,4b,8,8-tetramethyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthren-2-ol
SYSTEMATIC NAME: (2R,4aS,4bS,8aS)-2,4b,8,8-tetramethyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthren-2-ol
MOLECULAR FORMULA: C18H30O
MOLECULAR WEIGHT: 262.4302
SMILES: C[C@]1(CC[C@H]2C(=CC[C@@H]3[C@@]2(CCCC3(C)C)C)C1)O
Structure:
CAS RN: 87553-43-3
CAS Name: (1R,4aS,7S,7aS)-1,7-dihydroxy-7-(hydroxymethyl)-4a,7a-dihydro-1H-cyclopenta[c]pyran-4-carboxylic acid methyl ester
OPENEYE Name: methyl (1R,4aS,7S,7aS)-1,7-dihydroxy-7-(hydroxymethyl)-4a,7a-dihydro-1H-cyclopenta[c]pyran-4-carboxylate
IUPAC Name: methyl (1R,4aS,7S,7aS)-1,7-dihydroxy-7-(hydroxymethyl)-4a,7a-dihydro-1H-cyclopenta[c]pyran-4-carboxylate
SYSTEMATIC NAME: methyl (1R,4aS,7S,7aS)-7-(hydroxymethyl)-1,7-bis(oxidanyl)-4a,7a-dihydro-1H-cyclopenta[c]pyran-4-carboxylate
MOLECULAR FORMULA: C11H14O6
MOLECULAR WEIGHT: 242.22526
SMILES: COC(=O)C1=CO[C@H]([C@H]2[C@@H]1C=C[C@]2(CO)O)O
Structure:
CAS RN: 87550-01-4
CAS Name: (3aS,5aR,6R,9bS)-6-hydroxy-5a,9-dimethyl-3-methylene-3a,4,5,6,7,9b-hexahydrobenzo[g]benzofuran-2,8-dione
OPENEYE Name: (3aS,5aR,6R,9bS)-6-hydroxy-5a,9-dimethyl-3-methylene-3a,4,5,6,7,9b-hexahydrobenzo[g]benzofuran-2,8-dione
IUPAC Name: (3aS,5aR,6R,9bS)-6-hydroxy-5a,9-dimethyl-3-methylidene-3a,4,5,6,7,9b-hexahydrobenzo[g][1]benzofuran-2,8-dione
SYSTEMATIC NAME: (3aS,5aR,6R,9bS)-5a,9-dimethyl-3-methylidene-6-oxidanyl-3a,4,5,6,7,9b-hexahydrobenzo[g][1]benzofuran-2,8-dione
MOLECULAR FORMULA: C15H18O4
MOLECULAR WEIGHT: 262.30102
SMILES: CC1=C2[C@@H]3[C@@H](CC[C@]2([C@@H](CC1=O)O)C)C(=C)C(=O)O3
Structure:
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