CAS RN: 14024-61-4
CAS Name: (Z)-4-hydroxy-3-penten-2-one; palladium
OPENEYE Name: (Z)-4-hydroxypent-3-en-2-one; palladium
IUPAC Name: (Z)-4-hydroxypent-3-en-2-one; palladium
SYSTEMATIC NAME: (Z)-4-oxidanylpent-3-en-2-one; palladium
MOLECULAR FORMULA: C10H16O4Pd
MOLECULAR WEIGHT: 306.65164
SMILES: C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.[Pd]
Structure:
CAS RN: 18652-40-9
CAS Name: (Z)-11-(3-pentyl-2-oxiranyl)-9-undecenoic acid methyl ester
OPENEYE Name: methyl (Z)-11-(3-pentyloxiran-2-yl)undec-9-enoate
IUPAC Name: methyl (Z)-11-(3-pentyloxiran-2-yl)undec-9-enoate
SYSTEMATIC NAME: methyl (Z)-11-(3-pentyloxiran-2-yl)undec-9-enoate
MOLECULAR FORMULA: C19H34O3
MOLECULAR WEIGHT: 310.47146
SMILES: CCCCCC1C(O1)C/C=C\CCCCCCCC(=O)OC
Structure:
CAS RN: 2997-85-5
CAS Name: (E)-2-butenedioic acid dioctyl ester
OPENEYE Name: dioctyl (E)-but-2-enedioate
IUPAC Name: dioctyl (E)-but-2-enedioate
SYSTEMATIC NAME: dioctyl (E)-but-2-enedioate
MOLECULAR FORMULA: C20H36O4
MOLECULAR WEIGHT: 340.49744
SMILES: CCCCCCCCOC(=O)/C=C/C(=O)OCCCCCCCC
Structure:
CAS RN: 68921-50-6
CAS Name: (E)-2-butenedioic acid dioctyl ester
OPENEYE Name: dioctyl (E)-but-2-enedioate
IUPAC Name: dioctyl (E)-but-2-enedioate
SYSTEMATIC NAME: dioctyl (E)-but-2-enedioate
MOLECULAR FORMULA: C20H36O4
MOLECULAR WEIGHT: 340.49744
SMILES: CCCCCCCCOC(=O)/C=C/C(=O)OCCCCCCCC
Structure:
CAS RN: 15489-81-3
CAS Name: copper (Z)-5-oxo-3-hexen-3-olate
OPENEYE Name: copper (Z)-5-oxohex-3-en-3-olate
IUPAC Name: copper (Z)-5-oxohex-3-en-3-olate
SYSTEMATIC NAME: copper (Z)-5-oxidanylidenehex-3-en-3-olate
MOLECULAR FORMULA: C12H18CuO4
MOLECULAR WEIGHT: 289.81492
SMILES: CC/C(=C/C(=O)C)/[O-].CC/C(=C/C(=O)C)/[O-].[Cu+2]
Structure:
CAS RN: 538-42-1
CAS Name: sodium (E)-3-phenyl-2-propenoate
OPENEYE Name: sodium (E)-3-phenylprop-2-enoate
IUPAC Name: sodium (E)-3-phenylprop-2-enoate
SYSTEMATIC NAME: sodium (E)-3-phenylprop-2-enoate
MOLECULAR FORMULA: C9H7NaO2
MOLECULAR WEIGHT: 170.14045
SMILES: C1=CC=C(C=C1)/C=C/C(=O)[O-].[Na+]
Structure:
CAS RN: 1956-39-4
CAS Name: 1-(4-chlorophenyl)ethanone oxime
OPENEYE Name: 1-(4-chlorophenyl)ethanone oxime
IUPAC Name: (NZ)-N-[1-(4-chlorophenyl)ethylidene]hydroxylamine
SYSTEMATIC NAME: (NZ)-N-[1-(4-chlorophenyl)ethylidene]hydroxylamine
MOLECULAR FORMULA: C8H8ClNO
MOLECULAR WEIGHT: 169.60822
SMILES: C/C(=N/O)/C1=CC=C(C=C1)Cl
Structure:
CAS RN: 3018-09-5
CAS Name: (E)-1-bromo-2-chloroethene
OPENEYE Name: (E)-1-bromo-2-chloro-ethylene
IUPAC Name: (E)-1-bromo-2-chloroethene
SYSTEMATIC NAME: (E)-1-bromanyl-2-chloranyl-ethene
MOLECULAR FORMULA: C2H2BrCl
MOLECULAR WEIGHT: 141.39428
SMILES: C(=C/Br)\Cl
Structure:
CAS RN: 69772-54-9
CAS Name: (4R)-3-methyl-2-[(2E,4R)-2-(6-oxo-1-cyclohexa-2,4-dienylidene)-4-thiazolidinyl]-4-thiazolidinecarboxylic acid
OPENEYE Name: (4R)-3-methyl-2-[(2E,4R)-2-(6-oxocyclohexa-2,4-dien-1-ylidene)thiazolidin-4-yl]thiazolidine-4-carboxylic acid
IUPAC Name: (4R)-3-methyl-2-[(2E,4R)-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,3-thiazolidin-4-yl]-1,3-thiazolidine-4-carboxylic acid
SYSTEMATIC NAME: (4R)-3-methyl-2-[(2E,4R)-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,3-thiazolidin-4-yl]-1,3-thiazolidine-4-carboxylic acid
MOLECULAR FORMULA: C14H16N2O3S2
MOLECULAR WEIGHT: 324.41844
SMILES: CN1[C@@H](CSC1[C@H]2CS/C(=C/3\C=CC=CC3=O)/N2)C(=O)O
Structure:
CAS RN: 191114-48-4
CAS Name: (1R,2R,4R,6S,7R,8R,10R,13R,14S)-7-[[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-2-oxanyl]oxy]-13-ethyl-6-methoxy-2,4,6,8,10,14-hexamethyl-17-[4-[4-(3-pyridinyl)-1-imidazolyl]butyl]-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,9,11,16-tetrone
OPENEYE Name: (1R,2R,4R,6S,7R,8R,10R,13R,14S)-7-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-13-ethyl-6-methoxy-2,4,6,8,10,14-hexamethyl-17-[4-[4-(3-pyridyl)imidazol-1-yl]butyl]-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,9,11,16-tetr
IUPAC Name: (1R,2R,4R,6S,7R,8R,10R,13R,14S)-7-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-13-ethyl-6-methoxy-2,4,6,8,10,14-hexamethyl-17-[4-(4-pyridin-3-ylimidazol-1-yl)butyl]-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,9,11,16-tetrone
SYSTEMATIC NAME: (1R,2R,4R,6S,7R,8R,10R,13R,14S)-7-[(2S,3R,4S,6R)-4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-13-ethyl-6-methoxy-2,4,6,8,10,14-hexamethyl-17-[4-(4-pyridin-3-ylimidazol-1-yl)butyl]-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,9,11,16-tetrone
MOLECULAR FORMULA: C43H65N5O10
MOLECULAR WEIGHT: 812.0037
SMILES: CC[C@@H]1[C@@]2([C@@H]([C@H](C(=O)[C@@H](C[C@]([C@@H]([C@H](C(=O)[C@H](C(=O)O1)C)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)OC)C)C)N(C(=O)O2)CCCCN4C=C(N=C4)C5=CN=CC=C5)C
Structure:
CAS RN: 3882-38-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H23N
MOLECULAR WEIGHT: 241.37122
SMILES: CN1CC[C@]23CCCC[C@H]2[C@H]1CC4=CC=CC=C34
Structure:
CAS RN: 466-97-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H17NO3
MOLECULAR WEIGHT: 271.31108
SMILES: C1CN[C@@H]2CC3=C4[C@@]15[C@H]2C=C[C@@H]([C@@H]5OC4=C(C=C3)O)O
Structure:
CAS RN: 2784-73-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H21NO4
MOLECULAR WEIGHT: 327.37434
SMILES: CC(=O)O[C@H]1C=C[C@H]2[C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)O)CCN3C
Structure:
CAS RN: 47252-06-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H23NO3
MOLECULAR WEIGHT: 313.39082
SMILES: CCO[C@H]1C=C[C@H]2[C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)O)CCN3C
Structure:
CAS RN: 639-47-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H21NO3
MOLECULAR WEIGHT: 299.36424
SMILES: CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](C=C4)OC
Structure:
CAS RN: 5140-28-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H21NO4
MOLECULAR WEIGHT: 327.37434
SMILES: CC(=O)OC1=C2C3=C(C[C@@H]4[C@H]5[C@]3(CCN4C)[C@@H](O2)[C@H](C=C5)O)C=C1
Structure:
CAS RN: 29593-26-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H21NO4
MOLECULAR WEIGHT: 327.37434
SMILES: CC(=O)OC1=C2C3=C(C[C@@H]4[C@H]5[C@]3(CCN4C)[C@@H](O2)[C@H](C=C5)O)C=C1
Structure:
CAS RN: 18910-65-1
CAS Name: 4-[(1R)-1-hydroxy-2-[[(2R)-1-(4-methoxyphenyl)propan-2-yl]amino]ethyl]-2-(hydroxymethyl)phenol
OPENEYE Name: 4-[(1R)-1-hydroxy-2-[[(1R)-2-(4-methoxyphenyl)-1-methyl-ethyl]amino]ethyl]-2-(hydroxymethyl)phenol
IUPAC Name: 4-[(1R)-1-hydroxy-2-[[(2R)-1-(4-methoxyphenyl)propan-2-yl]amino]ethyl]-2-(hydroxymethyl)phenol
SYSTEMATIC NAME: 2-(hydroxymethyl)-4-[(1R)-2-[[(2R)-1-(4-methoxyphenyl)propan-2-yl]amino]-1-oxidanyl-ethyl]phenol
MOLECULAR FORMULA: C19H25NO4
MOLECULAR WEIGHT: 331.4061
SMILES: C[C@H](CC1=CC=C(C=C1)OC)NC[C@@H](C2=CC(=C(C=C2)O)CO)O
Structure:
CAS RN: 76420-72-9
CAS Name: (2S)-1-[(2S)-2-[[(1S)-1-carboxy-3-phenylpropyl]amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid
OPENEYE Name: (2S)-1-[(2S)-2-[[(1S)-1-carboxy-3-phenyl-propyl]amino]propanoyl]pyrrolidine-2-carboxylic acid
IUPAC Name: (2S)-1-[(2S)-2-[[(1S)-1-carboxy-3-phenylpropyl]amino]propanoyl]pyrrolidine-2-carboxylic acid
SYSTEMATIC NAME: (2S)-1-[(2S)-2-[[(2S)-1-oxidanyl-1-oxidanylidene-4-phenyl-butan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid
MOLECULAR FORMULA: C18H24N2O5
MOLECULAR WEIGHT: 348.39356
SMILES: C[C@@H](C(=O)N1CCC[C@H]1C(=O)O)N[C@@H](CCC2=CC=CC=C2)C(=O)O
Structure:
CAS RN: 78123-71-4
CAS Name: (2S)-2-amino-N-[(2R)-1-[[2-[[(2S)-1-(2-hydroxyethylamino)-1-oxo-3-phenylpropan-2-yl]-methylamino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-3-(4-hydroxyphenyl)propanamide
OPENEYE Name: (2S)-2-amino-N-[(1R)-2-[[2-[[(1S)-1-benzyl-2-(2-hydroxyethylamino)-2-oxo-ethyl]-methyl-amino]-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl]-3-(4-hydroxyphenyl)propanamide
IUPAC Name: (2S)-2-amino-N-[(2R)-1-[[2-[[(2S)-1-(2-hydroxyethylamino)-1-oxo-3-phenylpropan-2-yl]-methylamino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-3-(4-hydroxyphenyl)propanamide
SYSTEMATIC NAME: (2S)-2-azanyl-N-[(2R)-1-[[2-[[(2S)-1-(2-hydroxyethylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]-methyl-amino]-2-oxidanylidene-ethyl]amino]-1-oxidanylidene-propan-2-yl]-3-(4-hydroxyphenyl)propanamide
MOLECULAR FORMULA: C26H35N5O6
MOLECULAR WEIGHT: 513.586
SMILES: C[C@H](C(=O)NCC(=O)N(C)[C@@H](CC1=CC=CC=C1)C(=O)NCCO)NC(=O)[C@H](CC2=CC=C(C=C2)O)N
Structure:
CAS RN: 91147-20-5
CAS Name: 1-[1,3-dihydroxy-10-methyl-4-(3-methylbut-2-enyl)-9-oxo-2-acridinyl]-6-hydroxy-3,3-dimethyl-2,12-dihydro-1H-pyrano[2,3-c]acridin-7-one
OPENEYE Name: 1-[1,3-dihydroxy-10-methyl-4-(3-methylbut-2-enyl)-9-oxo-acridin-2-yl]-6-hydroxy-3,3-dimethyl-2,12-dihydro-1H-pyrano[2,3-c]acridin-7-one
IUPAC Name: 1-[1,3-dihydroxy-10-methyl-4-(3-methylbut-2-enyl)-9-oxoacridin-2-yl]-6-hydroxy-3,3-dimethyl-2,12-dihydro-1H-pyrano[2,3-c]acridin-7-one
SYSTEMATIC NAME: 3,3-dimethyl-1-[10-methyl-4-(3-methylbut-2-enyl)-1,3-bis(oxidanyl)-9-oxidanylidene-acridin-2-yl]-6-oxidanyl-2,12-dihydro-1H-pyrano[2,3-c]acridin-7-one
MOLECULAR FORMULA: C37H34N2O6
MOLECULAR WEIGHT: 602.67566
SMILES: CC(=CCC1=C(C(=C(C2=C1N(C3=CC=CC=C3C2=O)C)O)C4CC(OC5=CC(=C6C(=C45)NC7=CC=CC=C7C6=O)O)(C)C)O)C
Structure:
CAS RN: 2115-98-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H25NO5
MOLECULAR WEIGHT: 371.4269
SMILES: CN1CC[C@@]23C=C(C(=O)C=C2[C@@H]1CCC4=CC(=C(C(=C34)OC)O)OC)OC
Structure:
CAS RN: 570-19-4
CAS Name: (2R)-2,3-dihydroxy-2-[(1S)-1-methoxyethyl]-3-methylbutanoic acid [(7S,8R)-7-hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl ester
OPENEYE Name: [(7S,8R)-7-hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2R)-2,3-dihydroxy-2-[(1S)-1-methoxyethyl]-3-methyl-butanoate
IUPAC Name: [(7S,8R)-7-hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2R)-2,3-dihydroxy-2-[(1S)-1-methoxyethyl]-3-methylbutanoate
SYSTEMATIC NAME: [(7S,8R)-7-oxidanyl-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2R)-2-[(1S)-1-methoxyethyl]-3-methyl-2,3-bis(oxidanyl)butanoate
MOLECULAR FORMULA: C16H27NO6
MOLECULAR WEIGHT: 329.38868
SMILES: C[C@@H]([C@](C(=O)OCC1=CCN2[C@H]1[C@H](CC2)O)(C(C)(C)O)O)OC
Structure:
CAS RN: 3279-74-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H26N2O
MOLECULAR WEIGHT: 274.40114
SMILES: C[C@@H]1C[C@H]2CC3=C(CCC(=O)N3)[C@@]4(C1)[C@H]2CCCN4C
Structure:
CAS RN: 596-55-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H26N2O
MOLECULAR WEIGHT: 274.40114
SMILES: C[C@@H]1C[C@H]2CC3=C(CCC(=O)N3)[C@@]4(C1)[C@@H]2CCCN4C
Structure:
CAS RN: 3175-90-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H29NO4
MOLECULAR WEIGHT: 323.42716
SMILES: C[C@H]1C[C@@]23[C@@H]4CCCN2CCC[C@@]3([C@@H]([C@@H]1O)C[C@H]4OC(=O)C)O
Structure:
CAS RN: 20316-18-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H22N2
MOLECULAR WEIGHT: 242.35928
SMILES: C[C@@H]1C[C@H]2CC3=C(C=CC=N3)[C@@]4(C1)[C@@H]2CCCN4
Structure:
CAS RN: 103548-82-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H20N2O
MOLECULAR WEIGHT: 256.3428
SMILES: CC1=C[C@H]2CC3=C(C=CC(=O)N3)[C@@]4(C1)[C@@H]2CCCN4
Structure:
CAS RN: 6900-86-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H28N2O
MOLECULAR WEIGHT: 288.42772
SMILES: C[C@@H]1C[C@H]2CC3=C(CCCN3C(=O)C)[C@@]4(C1)[C@@H]2CCCN4
Structure:
CAS RN: 664-23-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H25NO2
MOLECULAR WEIGHT: 263.3752
SMILES: C[C@@H]1C[C@]23[C@@H]4CCCN2CCC[C@@H]3[C@@H](C[C@@H]4C1=O)O
Structure:
CAS RN: 86413-81-2
CAS Name: (2R,3R,4R,5S)-2-[(1R)-1-[(2R,3R,4R,5R)-5-[2-[(4aR,6R)-6-[[(2R,3R,4R,5R)-5-[(1R)-1-[[(2R,3R,4R,5S)-5-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxy-2-oxolanyl]oxy]-2-hydroxyethyl]-3,4-dihydroxy-2-oxolanyl]oxy]-4a,8-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-y
OPENEYE Name: (2R,3R,4R,5S)-2-[(1R)-1-[(2R,3R,4R,5R)-5-[2-[(4aR,6R)-6-[(2R,3R,4R,5R)-5-[(1R)-1-[(2R,3R,4R,5S)-5-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxy-tetrahydrofuran-2-yl]oxy-2-hydroxy-ethyl]-3,4-dihydroxy-tetrahydrofuran-2-yl]oxy-4a,8-dimethyl-2,3,4,5,6,7-hexahydro-
IUPAC Name: (2R,3R,4R,5S)-2-[(1R)-1-[(2R,3R,4R,5R)-5-[2-[(4aR,6R)-6-[(2R,3R,4R,5R)-5-[(1R)-1-[(2R,3R,4R,5S)-5-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxyoxolan-2-yl]oxy-2-hydroxyethyl]-3,4-dihydroxyoxolan-2-yl]oxy-4a,8-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl]pr
SYSTEMATIC NAME: (2R,3R,4R,5S)-2-[(1R)-1-[(2R,3R,4R,5R)-5-[2-[(4aR,6R)-6-[(2R,3R,4R,5R)-5-[(1R)-1-[(2R,3R,4R,5S)-5-[(1R)-1,2-bis(oxidanyl)ethyl]-3,4-bis(oxidanyl)oxolan-2-yl]oxy-2-oxidanyl-ethyl]-3,4-bis(oxidanyl)oxolan-2-yl]oxy-4a,8-dimethyl-2,3,4,5,6,7-hexahydro-1H-naph
MOLECULAR FORMULA: C39H64O22
MOLECULAR WEIGHT: 884.91226
SMILES: CC1=C2CC(CC[C@@]2(C[C@@H](C1)O[C@H]3[C@@H]([C@H]([C@@H](O3)[C@@H](CO)O[C@H]4[C@@H]([C@H]([C@@H](O4)[C@@H](CO)O)O)O)O)O)C)C(=C)CO[C@H]5[C@@H]([C@H]([C@@H](O5)[C@@H](CO)O[C@H]6[C@@H]([C@H]([C@@H](O6)[C@@H](CO)O)O)O)O)O
Structure:
CAS RN: 7633-29-6
CAS Name: 1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-3,4-dihydro-2H-isoquinolin-6-one
OPENEYE Name: 1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-3,4-dihydro-2H-isoquinolin-6-one
IUPAC Name: 1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-3,4-dihydro-2H-isoquinolin-6-one
SYSTEMATIC NAME: 1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-3,4-dihydro-2H-isoquinolin-6-one
MOLECULAR FORMULA: C28H36N2O4
MOLECULAR WEIGHT: 464.59644
SMILES: CC[C@H]1CN2CCC3=CC(=C(C=C3[C@@H]2C[C@@H]1CC4=C5C=C(C(=O)C=C5CCN4)OC)OC)OC
Structure:
CAS RN: 467-14-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H21NO3
MOLECULAR WEIGHT: 299.36424
SMILES: CN1CC[C@]23[C@@H]4[C@H](CC=C2[C@H]1CC5=C3C(=C(C=C5)OC)O4)O
Structure:
CAS RN: 61490-63-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H18O4
MOLECULAR WEIGHT: 262.30102
SMILES: C[C@@H]1C[C@@H]2[C@H](C[C@@]34[C@H]1[C@@H](CC3=O)OC4)C(=C)C(=O)O2
Structure:
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