CAS RN: 22541-21-5
CAS Name: dysprosium(3+)
OPENEYE Name: dysprosium(3+)
IUPAC Name: dysprosium(3+)
SYSTEMATIC NAME: dysprosium(3+)
MOLECULAR FORMULA: Dy+3
MOLECULAR WEIGHT: 162.5
SMILES: [Dy+3]
Structure:
CAS RN: 22541-14-6
CAS Name: praseodymium(3+)
OPENEYE Name: praseodymium(3+)
IUPAC Name: praseodymium(3+)
SYSTEMATIC NAME: praseodymium(3+)
MOLECULAR FORMULA: Pr+3
MOLECULAR WEIGHT: 140.90765
SMILES: [Pr+3]
Structure:
CAS RN: 22367-12-0
CAS Name: 2-(3-chlorophenyl)-4H-isoquinoline-1,3-dione
OPENEYE Name: 2-(3-chlorophenyl)-4H-isoquinoline-1,3-dione
IUPAC Name: 2-(3-chlorophenyl)-4H-isoquinoline-1,3-dione
SYSTEMATIC NAME: 2-(3-chlorophenyl)-4H-isoquinoline-1,3-dione
MOLECULAR FORMULA: C15H10ClNO2
MOLECULAR WEIGHT: 271.6984
SMILES: C1C2=CC=CC=C2C(=O)N(C1=O)C3=CC(=CC=C3)Cl
Structure:
CAS RN: 22322-28-7
CAS Name: calcium hexanedioate
OPENEYE Name: calcium hexanedioate
IUPAC Name: calcium hexanedioate
SYSTEMATIC NAME: calcium hexanedioate
MOLECULAR FORMULA: C6H8CaO4
MOLECULAR WEIGHT: 184.20332
SMILES: C(CCC(=O)[O-])CC(=O)[O-].[Ca+2]
Structure:
CAS RN: 254-27-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C26H28O9
MOLECULAR WEIGHT: 484.49512
SMILES: C[C@@]12CC[C@H]3[C@]([C@@]14[C@H](O4)C(=O)O[C@H]2C5=COC=C5)(C(=O)C(=C6[C@@]37COC(=O)C[C@@H]7OC6(C)C)O)C
Structure:
CAS RN: 25332-09-6
CAS Name: hexadecanoic acid [(3S,6aR,6bS,8aR,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl] ester
OPENEYE Name: [(3S,6aR,6bS,8aR,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl] hexadecanoate
IUPAC Name: [(3S,6aR,6bS,8aR,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl] hexadecanoate
SYSTEMATIC NAME: [(3S,6aR,6bS,8aR,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl] hexadecanoate
MOLECULAR FORMULA: C46H80O2
MOLECULAR WEIGHT: 665.1262
SMILES: CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC=C4[C@H]5[C@H]([C@@H](CC[C@@]5(CC[C@]4([C@@]3(CCC2C1(C)C)C)C)C)C)C)C
Structure:
CAS RN: 290299-11-5
CAS Name: hexadecanoic acid [(3S,6aR,6bS,8aR,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl] ester
OPENEYE Name: [(3S,6aR,6bS,8aR,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl] hexadecanoate
IUPAC Name: [(3S,6aR,6bS,8aR,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl] hexadecanoate
SYSTEMATIC NAME: [(3S,6aR,6bS,8aR,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl] hexadecanoate
MOLECULAR FORMULA: C46H80O2
MOLECULAR WEIGHT: 665.1262
SMILES: CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC=C4[C@H]5[C@H]([C@@H](CC[C@@]5(CC[C@]4([C@@]3(CCC2C1(C)C)C)C)C)C)C)C
Structure:
CAS RN: 13844-01-4
CAS Name: (3R,4R,4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-4a-(hydroxymethyl)-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-3,4,5,10-tetrol
OPENEYE Name: (3R,4R,4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-4a-(hydroxymethyl)-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-3,4,5,10-tetrol
IUPAC Name: (3R,4R,4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-4a-(hydroxymethyl)-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-3,4,5,10-tetrol
SYSTEMATIC NAME: (3R,4R,4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-4a-(hydroxymethyl)-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-3,4,5,10-tetrol
MOLECULAR FORMULA: C30H50O5
MOLECULAR WEIGHT: 490.715
SMILES: C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(C[C@H]([C@@]5([C@H]4CC([C@H]([C@@H]5O)O)(C)C)CO)O)C)C)(C)C)O
Structure:
CAS RN: 36093-47-7
CAS Name: N-[3-chloro-4-[(4-chlorophenyl)-oxomethyl]phenyl]-2-hydroxy-3,5-diiodobenzamide
OPENEYE Name: N-[3-chloro-4-(4-chlorobenzoyl)phenyl]-2-hydroxy-3,5-diiodo-benzamide
IUPAC Name: N-[3-chloro-4-(4-chlorobenzoyl)phenyl]-2-hydroxy-3,5-diiodobenzamide
SYSTEMATIC NAME: N-[3-chloranyl-4-(4-chlorophenyl)carbonyl-phenyl]-3,5-bis(iodanyl)-2-oxidanyl-benzamide
MOLECULAR FORMULA: C20H11Cl2I2NO3
MOLECULAR WEIGHT: 638.02118
SMILES: C1=CC(=CC=C1C(=O)C2=C(C=C(C=C2)NC(=O)C3=CC(=CC(=C3O)I)I)Cl)Cl
Structure:
CAS RN: 157212-55-0
CAS Name: 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-(2-pyrimidinyl)-4-pyrimidinyl]benzenesulfonamide hydrate
OPENEYE Name: 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-pyrimidin-4-yl]benzenesulfonamide hydrate
IUPAC Name: 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]benzenesulfonamide hydrate
SYSTEMATIC NAME: 4-tert-butyl-N-[6-(2-hydroxyethyloxy)-5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-pyrimidin-4-yl]benzenesulfonamide hydrate
MOLECULAR FORMULA: C27H31N5O7S
MOLECULAR WEIGHT: 569.62934
SMILES: CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=NC=CC=N3)OCCO)OC4=CC=CC=C4OC.O
Structure:
CAS RN: 54063-27-3
CAS Name: 2,2-bis(4-chlorophenoxy)acetic acid 1-(2-pyrrolidinyl)ethyl ester
OPENEYE Name: 1-pyrrolidin-2-ylethyl 2,2-bis(4-chlorophenoxy)acetate
IUPAC Name: 1-pyrrolidin-2-ylethyl 2,2-bis(4-chlorophenoxy)acetate
SYSTEMATIC NAME: 1-pyrrolidin-2-ylethyl 2,2-bis(4-chloranylphenoxy)ethanoate
MOLECULAR FORMULA: C20H21Cl2NO4
MOLECULAR WEIGHT: 410.29104
SMILES: CC(C1CCCN1)OC(=O)C(OC2=CC=C(C=C2)Cl)OC3=CC=C(C=C3)Cl
Structure:
CAS RN: 103725-47-9
CAS Name: 2-[[2-[[2-[[2-(benzoylthio)-1-oxoethyl]amino]-1-oxoethyl]amino]-1-oxoethyl]amino]acetic acid
OPENEYE Name: 2-[[2-[[2-[(2-benzoylsulfanylacetyl)amino]acetyl]amino]acetyl]amino]acetic acid
IUPAC Name: 2-[[2-[[2-[(2-benzoylsulfanylacetyl)amino]acetyl]amino]acetyl]amino]acetic acid
SYSTEMATIC NAME: 2-[2-[2-[2-(phenylcarbonylsulfanyl)ethanoylamino]ethanoylamino]ethanoylamino]ethanoic acid
MOLECULAR FORMULA: C15H17N3O6S
MOLECULAR WEIGHT: 367.37698
SMILES: C1=CC=C(C=C1)C(=O)SCC(=O)NCC(=O)NCC(=O)NCC(=O)O
Structure:
CAS RN: 15222-64-7
CAS Name: 2-(2,6-dimethoxyphenoxy)-N-[[(2R,3R)-3-phenyl-2,3-dihydro-1,4-benzodioxin-2-yl]methyl]ethanamine
OPENEYE Name: 2-(2,6-dimethoxyphenoxy)-N-[[(2R,3R)-3-phenyl-2,3-dihydro-1,4-benzodioxin-2-yl]methyl]ethanamine
IUPAC Name: 2-(2,6-dimethoxyphenoxy)-N-[[(2R,3R)-3-phenyl-2,3-dihydro-1,4-benzodioxin-2-yl]methyl]ethanamine
SYSTEMATIC NAME: 2-(2,6-dimethoxyphenoxy)-N-[[(2R,3R)-3-phenyl-2,3-dihydro-1,4-benzodioxin-2-yl]methyl]ethanamine
MOLECULAR FORMULA: C25H27NO5
MOLECULAR WEIGHT: 421.48558
SMILES: COC1=C(C(=CC=C1)OC)OCCNC[C@@H]2[C@H](OC3=CC=CC=C3O2)C4=CC=CC=C4
Structure:
CAS RN: 15254-35-0
CAS Name: 1-[[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-piperidinyl]amino]-3-(1-naphthalenyloxy)-2-propanol
OPENEYE Name: 1-[[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-piperidyl]amino]-3-(1-naphthyloxy)propan-2-ol
IUPAC Name: 1-[[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-yl]amino]-3-naphthalen-1-yloxypropan-2-ol
SYSTEMATIC NAME: 1-[[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-yl]amino]-3-naphthalen-1-yloxy-propan-2-ol
MOLECULAR FORMULA: C27H32N2O4
MOLECULAR WEIGHT: 448.55398
SMILES: C1CN(CCC1NCC(COC2=CC=CC3=CC=CC=C32)O)CC4COC5=CC=CC=C5O4
Structure:
CAS RN: 95093-99-5
CAS Name: (2R)-1-(9H-carbazol-4-yloxy)-3-[2-(2-methoxyphenoxy)ethylamino]-2-propanol
OPENEYE Name: (2R)-1-(9H-carbazol-4-yloxy)-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-ol
IUPAC Name: (2R)-1-(9H-carbazol-4-yloxy)-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-ol
SYSTEMATIC NAME: (2R)-1-(9H-carbazol-4-yloxy)-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-ol
MOLECULAR FORMULA: C24H26N2O4
MOLECULAR WEIGHT: 406.47424
SMILES: COC1=CC=CC=C1OCCNC[C@H](COC2=CC=CC3=C2C4=CC=CC=C4N3)O
Structure:
CAS RN: 63734-10-1
CAS Name: 2,2,2-trichloro-1,1-bis(4-chlorophenyl)ethanol; 1,2,4-trichloro-5-(4-chlorophenyl)sulfonylbenzene
OPENEYE Name: 2,2,2-trichloro-1,1-bis(4-chlorophenyl)ethanol; 1,2,4-trichloro-5-(4-chlorophenyl)sulfonyl-benzene
IUPAC Name: 2,2,2-trichloro-1,1-bis(4-chlorophenyl)ethanol; 1,2,4-trichloro-5-(4-chlorophenyl)sulfonylbenzene
SYSTEMATIC NAME: 2,2,2-tris(chloranyl)-1,1-bis(4-chlorophenyl)ethanol; 1,2,4-tris(chloranyl)-5-(4-chlorophenyl)sulfonyl-benzene
MOLECULAR FORMULA: C26H15Cl9O3S
MOLECULAR WEIGHT: 726.5375
SMILES: C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)(C(Cl)(Cl)Cl)O)Cl.C1=CC(=CC=C1S(=O)(=O)C2=CC(=C(C=C2Cl)Cl)Cl)Cl
Structure:
CAS RN: 94426-01-4
CAS Name: acetic acid [(2R,6R)-6-[(7S,8R,9R,10R,13R,14R,17R)-7-[[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-methylheptyl] ester
OPENEYE Name: [(2R,6R)-6-[(7S,8R,9R,10R,13R,14R,17R)-7-[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-heptyl] acetate
IUPAC Name: [(2R,6R)-6-[(7S,8R,9R,10R,13R,14R,17R)-7-[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-methylheptyl] acetate
SYSTEMATIC NAME: [(2R,6R)-6-[(7S,8R,9R,10R,13R,14R,17R)-7-[(2R,3R,4R,5S,6R)-3-acetamido-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]oxy-10,13-dimethyl-3-oxidanylidene-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-heptyl] ethanoate
MOLECULAR FORMULA: C37H59NO9
MOLECULAR WEIGHT: 661.86566
SMILES: C[C@H](CCC[C@@H](C)[C@H]1CC[C@H]2[C@@]1(CC[C@@H]3[C@@H]2[C@H](CC4=CC(=O)CC[C@]34C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)NC(=O)C)C)COC(=O)C
Structure:
CAS RN: 93973-22-9
CAS Name: 3,4,6-trimethoxydibenzofuran-2,7-diol
OPENEYE Name: 3,4,6-trimethoxydibenzofuran-2,7-diol
IUPAC Name: 3,4,6-trimethoxydibenzofuran-2,7-diol
SYSTEMATIC NAME: 3,4,6-trimethoxydibenzofuran-2,7-diol
MOLECULAR FORMULA: C15H14O6
MOLECULAR WEIGHT: 290.26806
SMILES: COC1=C(C=CC2=C1OC3=C(C(=C(C=C23)O)OC)OC)O
Structure:
CAS RN: 93802-98-3
CAS Name: acetic acid [10-formyl-14-hydroxy-13-methyl-17-(6-oxo-3-pyranyl)-3-[(3,4,5-trihydroxy-6-methyl-2-oxanyl)oxy]-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-5-yl] ester
OPENEYE Name: [10-formyl-14-hydroxy-13-methyl-17-(6-oxopyran-3-yl)-3-(3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl)oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-5-yl] acetate
IUPAC Name: [10-formyl-14-hydroxy-13-methyl-17-(6-oxopyran-3-yl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-5-yl] acetate
SYSTEMATIC NAME: [10-methanoyl-13-methyl-3-[6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-14-oxidanyl-17-(6-oxidanylidenepyran-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-5-yl] ethanoate
MOLECULAR FORMULA: C32H44O11
MOLECULAR WEIGHT: 604.68516
SMILES: CC1C(C(C(C(O1)OC2CCC3(C4CCC5(C(CCC5(C4CCC3(C2)OC(=O)C)O)C6=COC(=O)C=C6)C)C=O)O)O)O
Structure:
CAS RN: 617-92-5
CAS Name: 1-ethylpyrrole
OPENEYE Name: 1-ethylpyrrole
IUPAC Name: 1-ethylpyrrole
SYSTEMATIC NAME: 1-ethylpyrrole
MOLECULAR FORMULA: C6H9N
MOLECULAR WEIGHT: 95.14236
SMILES: CCN1C=CC=C1
Structure:
CAS RN: 92911-82-5
CAS Name: 2-[2-(4-methoxyphenyl)ethyl]-1-benzopyran-4-one
OPENEYE Name: 2-[2-(4-methoxyphenyl)ethyl]chromen-4-one
IUPAC Name: 2-[2-(4-methoxyphenyl)ethyl]chromen-4-one
SYSTEMATIC NAME: 2-[2-(4-methoxyphenyl)ethyl]chromen-4-one
MOLECULAR FORMULA: C18H16O3
MOLECULAR WEIGHT: 280.31784
SMILES: COC1=CC=C(C=C1)CCC2=CC(=O)C3=CC=CC=C3O2
Structure:
CAS RN: 92680-80-3
CAS Name: (1aS,3S,4R,4aR,8aR)-3-hydroxy-3,4a,8,8-tetramethyl-1a,2,4,5,6,7-hexahydronaphtho[4,4a-b]oxirene-4-carboxylic acid
OPENEYE Name: (1aS,3S,4R,4aR,8aR)-3-hydroxy-3,4a,8,8-tetramethyl-1a,2,4,5,6,7-hexahydronaphtho[4,4a-b]oxirene-4-carboxylic acid
IUPAC Name: (1aS,3S,4R,4aR,8aR)-3-hydroxy-3,4a,8,8-tetramethyl-1a,2,4,5,6,7-hexahydronaphtho[4,4a-b]oxirene-4-carboxylic acid
SYSTEMATIC NAME: (1aS,3S,4R,4aR,8aR)-3,4a,8,8-tetramethyl-3-oxidanyl-1a,2,4,5,6,7-hexahydronaphtho[4,4a-b]oxirene-4-carboxylic acid
MOLECULAR FORMULA: C15H24O4
MOLECULAR WEIGHT: 268.34866
SMILES: C[C@]12CCCC([C@]13[C@@H](O3)C[C@]([C@@H]2C(=O)O)(C)O)(C)C
Structure:
CAS RN: 103776-41-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H20O6
MOLECULAR WEIGHT: 296.3157
SMILES: CC1=C(C(=O)[C@]2([C@@H](C1)O[C@@H]3[C@@H](C[C@]2(C34CO4)C)O)CO)O
Structure:
CAS RN: 91668-36-9
CAS Name: (4aS,6S,7R,7aS)-6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-7-methyl-1-oxo-5,6,7,7a-tetrahydro-4aH-cyclopenta[c]pyridine-4-carboxylic acid methyl ester
OPENEYE Name: methyl (4aS,6S,7R,7aS)-6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-7-methyl-1-oxo-5,6,7,7a-tetrahydro-4aH-cyclopenta[c]pyridine-4-carboxylate
IUPAC Name: methyl (4aS,6S,7R,7aS)-6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-7-methyl-1-oxo-5,6,7,7a-tetrahydro-4aH-cyclopenta[c]pyridine-4-carboxylate
SYSTEMATIC NAME: methyl (4aS,6S,7R,7aS)-2-[2-(4-hydroxyphenyl)ethyl]-7-methyl-6-oxidanyl-1-oxidanylidene-5,6,7,7a-tetrahydro-4aH-cyclopenta[c]pyridine-4-carboxylate
MOLECULAR FORMULA: C19H23NO5
MOLECULAR WEIGHT: 345.38962
SMILES: C[C@H]1[C@H](C[C@H]2[C@@H]1C(=O)N(C=C2C(=O)OC)CCC3=CC=C(C=C3)O)O
Structure:
CAS RN: 91641-21-3
CAS Name: 2-(2-methoxy-4-prop-2-enylphenoxy)acetamide
OPENEYE Name: 2-(4-allyl-2-methoxy-phenoxy)acetamide
IUPAC Name: 2-(2-methoxy-4-prop-2-enylphenoxy)acetamide
SYSTEMATIC NAME: 2-(2-methoxy-4-prop-2-enyl-phenoxy)ethanamide
MOLECULAR FORMULA: C12H15NO3
MOLECULAR WEIGHT: 221.2524
SMILES: COC1=C(C=CC(=C1)CC=C)OCC(=O)N
Structure:
CAS RN: 80151-77-5
CAS Name: (1S,2S,8S)-2-hydroxy-2-methyl-1,3,5,6,7,8-hexahydropyrrolizine-1-carboxylic acid methyl ester
OPENEYE Name: methyl (1S,2S,8S)-2-hydroxy-2-methyl-1,3,5,6,7,8-hexahydropyrrolizine-1-carboxylate
IUPAC Name: methyl (1S,2S,8S)-2-hydroxy-2-methyl-1,3,5,6,7,8-hexahydropyrrolizine-1-carboxylate
SYSTEMATIC NAME: methyl (1S,2S,8S)-2-methyl-2-oxidanyl-1,3,5,6,7,8-hexahydropyrrolizine-1-carboxylate
MOLECULAR FORMULA: C10H17NO3
MOLECULAR WEIGHT: 199.24688
SMILES: C[C@]1(CN2CCC[C@H]2[C@@H]1C(=O)OC)O
Structure:
CAS RN: 90771-20-3
CAS Name: 5-[(2-hydroxyphenyl)methylidene]imidazolidine-2,4-dione
OPENEYE Name: 5-[(2-hydroxyphenyl)methylene]imidazolidine-2,4-dione
IUPAC Name: 5-[(2-hydroxyphenyl)methylidene]imidazolidine-2,4-dione
SYSTEMATIC NAME: 5-[(2-hydroxyphenyl)methylidene]imidazolidine-2,4-dione
MOLECULAR FORMULA: C10H8N2O3
MOLECULAR WEIGHT: 204.18212
SMILES: C1=CC=C(C(=C1)C=C2C(=O)NC(=O)N2)O
Structure:
CAS RN: 90632-69-2
CAS Name: 5-ethoxy-6-[1-(4-ethoxyphenyl)ethyl]-1,3-benzodioxole
OPENEYE Name: 5-ethoxy-6-[1-(4-ethoxyphenyl)ethyl]-1,3-benzodioxole
IUPAC Name: 5-ethoxy-6-[1-(4-ethoxyphenyl)ethyl]-1,3-benzodioxole
SYSTEMATIC NAME: 5-ethoxy-6-[1-(4-ethoxyphenyl)ethyl]-1,3-benzodioxole
MOLECULAR FORMULA: C19H22O4
MOLECULAR WEIGHT: 314.37558
SMILES: CCOC1=CC=C(C=C1)C(C)C2=CC3=C(C=C2OCC)OCO3
Structure:
CAS RN: 90050-70-7
CAS Name: 2,6-dibromo-4-pyridinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 2,6-dibromopyridine-4-carboxylate
IUPAC Name: ethyl 2,6-dibromopyridine-4-carboxylate
SYSTEMATIC NAME: ethyl 2,6-bis(bromanyl)pyridine-4-carboxylate
MOLECULAR FORMULA: C8H7Br2NO2
MOLECULAR WEIGHT: 308.95468
SMILES: CCOC(=O)C1=CC(=NC(=C1)Br)Br
Structure:
CAS RN: 89528-41-6
CAS Name: 2-(aminomethyl)aniline; platinum(2+); dichloride
OPENEYE Name: 2-(aminomethyl)aniline; platinum(2+); dichloride
IUPAC Name: 2-(aminomethyl)aniline; platinum(2+); dichloride
SYSTEMATIC NAME: 2-(aminomethyl)aniline; platinum(2+); dichloride
MOLECULAR FORMULA: C7H10Cl2N2Pt
MOLECULAR WEIGHT: 388.1517
SMILES: C1=CC=C(C(=C1)CN)N.[Cl-].[Cl-].[Pt+2]
Structure:
CAS RN: 1392-28-5
CAS Name: (2R)-2-phenyl-2-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxy-2-oxanyl]oxymethyl]-2-oxanyl]oxy]acetonitrile
OPENEYE Name: (2R)-2-phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxytetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-acetonitrile
IUPAC Name: (2R)-2-phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxyacetonitrile
SYSTEMATIC NAME: (2R)-2-phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-tris(oxidanyl)-6-[[(2S,3R,4S,5R)-3,4,5-tris(oxidanyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-ethanenitrile
MOLECULAR FORMULA: C19H25NO10
MOLECULAR WEIGHT: 427.4025
SMILES: C1[C@H]([C@@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)O[C@@H](C#N)C3=CC=CC=C3)O)O)O)O)O)O
Structure:
CAS RN: 89366-02-9
CAS Name: acetic acid [(1S,4bR,5R,6aR,10aR,10bR,12aR)-1-(3-furanyl)-1-hydroxy-4b,7,7,10a,12a-pentamethyl-3,8-dioxo-5,6,6a,10b,11,12-hexahydronaphtho[2,1-f][2]benzopyran-5-yl] ester
OPENEYE Name: [(1S,4bR,5R,6aR,10aR,10bR,12aR)-1-(3-furyl)-1-hydroxy-4b,7,7,10a,12a-pentamethyl-3,8-dioxo-5,6,6a,10b,11,12-hexahydronaphtho[2,1-f]isochromen-5-yl] acetate
IUPAC Name: [(1S,4bR,5R,6aR,10aR,10bR,12aR)-1-(furan-3-yl)-1-hydroxy-4b,7,7,10a,12a-pentamethyl-3,8-dioxo-5,6,6a,10b,11,12-hexahydronaphtho[2,1-f]isochromen-5-yl] acetate
SYSTEMATIC NAME: [(1S,4bR,5R,6aR,10aR,10bR,12aR)-1-(furan-3-yl)-4b,7,7,10a,12a-pentamethyl-1-oxidanyl-3,8-bis(oxidanylidene)-5,6,6a,10b,11,12-hexahydronaphtho[2,1-f]isochromen-5-yl] ethanoate
MOLECULAR FORMULA: C28H34O7
MOLECULAR WEIGHT: 482.56536
SMILES: CC(=O)O[C@@H]1C[C@@H]2[C@](C=CC(=O)C2(C)C)([C@@H]3[C@@]1(C4=CC(=O)O[C@@]([C@@]4(CC3)C)(C5=COC=C5)O)C)C
Structure:
CAS RN: 108205-07-8
CAS Name: 1-ethoxy-4-[1-[(3-phenoxyphenyl)methoxymethyl]cyclopropyl]benzene
OPENEYE Name: 1-ethoxy-4-[1-[(3-phenoxyphenyl)methoxymethyl]cyclopropyl]benzene
IUPAC Name: 1-ethoxy-4-[1-[(3-phenoxyphenyl)methoxymethyl]cyclopropyl]benzene
SYSTEMATIC NAME: 1-ethoxy-4-[1-[(3-phenoxyphenyl)methoxymethyl]cyclopropyl]benzene
MOLECULAR FORMULA: C25H26O3
MOLECULAR WEIGHT: 374.47214
SMILES: CCOC1=CC=C(C=C1)C2(CC2)COCC3=CC(=CC=C3)OC4=CC=CC=C4
Structure:
CAS RN: 95265-44-4
CAS Name: 1-ethoxy-4-[1-[(3-phenoxyphenyl)methoxymethyl]cyclopropyl]benzene
OPENEYE Name: 1-ethoxy-4-[1-[(3-phenoxyphenyl)methoxymethyl]cyclopropyl]benzene
IUPAC Name: 1-ethoxy-4-[1-[(3-phenoxyphenyl)methoxymethyl]cyclopropyl]benzene
SYSTEMATIC NAME: 1-ethoxy-4-[1-[(3-phenoxyphenyl)methoxymethyl]cyclopropyl]benzene
MOLECULAR FORMULA: C25H26O3
MOLECULAR WEIGHT: 374.47214
SMILES: CCOC1=CC=C(C=C1)C2(CC2)COCC3=CC(=CC=C3)OC4=CC=CC=C4
Structure:
CAS RN: 88738-78-7
CAS Name: 2-[bis(2,2,2-trifluoroethoxy)phosphoryl]acetic acid methyl ester
OPENEYE Name: methyl 2-[bis(2,2,2-trifluoroethoxy)phosphoryl]acetate
IUPAC Name: methyl 2-[bis(2,2,2-trifluoroethoxy)phosphoryl]acetate
SYSTEMATIC NAME: methyl 2-[bis[2,2,2-tris(fluoranyl)ethoxy]phosphoryl]ethanoate
MOLECULAR FORMULA: C7H9F6O5P
MOLECULAR WEIGHT: 318.10754
SMILES: COC(=O)CP(=O)(OCC(F)(F)F)OCC(F)(F)F
Structure:
CAS RN: 88704-50-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C14H16BrN3O2S
MOLECULAR WEIGHT: 370.26474
SMILES: C1CN2[C@@H]([C@@H](CSCO2)N)C3=C1C4=CC(=C(C=C4N3)Br)O
Structure:
CAS RN: 5448-45-3
CAS Name: 2-[4-(4-chlorophenyl)-2-(diethylamino)-5-thiazolyl]acetic acid
OPENEYE Name: 2-[4-(4-chlorophenyl)-2-(diethylamino)thiazol-5-yl]acetic acid
IUPAC Name: 2-[4-(4-chlorophenyl)-2-(diethylamino)-1,3-thiazol-5-yl]acetic acid
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)-2-(diethylamino)-1,3-thiazol-5-yl]ethanoic acid
MOLECULAR FORMULA: C15H17ClN2O2S
MOLECULAR WEIGHT: 324.82568
SMILES: CCN(CC)C1=NC(=C(S1)CC(=O)O)C2=CC=C(C=C2)Cl
Structure:
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