CAS RN: 5626-70-0
CAS Name: 6-acetyl-7-methyl-3-pyrazolo[1,5-a]pyrimidinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 6-acetyl-7-methyl-pyrazolo[1,5-a]pyrimidine-3-carboxylate
IUPAC Name: ethyl 6-acetyl-7-methylpyrazolo[1,5-a]pyrimidine-3-carboxylate
SYSTEMATIC NAME: ethyl 6-ethanoyl-7-methyl-pyrazolo[1,5-a]pyrimidine-3-carboxylate
MOLECULAR FORMULA: C12H13N3O3
MOLECULAR WEIGHT: 247.24992
SMILES: CCOC(=O)C1=C2N=CC(=C(N2N=C1)C)C(=O)C
Structure:
CAS RN: 10136-64-8
CAS Name: 6-phenyl-2-imidazo[2,1-b][1,3,4]thiadiazolamine
OPENEYE Name: 6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-amine
IUPAC Name: 6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-amine
SYSTEMATIC NAME: 6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-amine
MOLECULAR FORMULA: C10H8N4S
MOLECULAR WEIGHT: 216.26232
SMILES: C1=CC=C(C=C1)C2=CN3C(=N2)SC(=N3)N
Structure:
CAS RN: 22252-15-9
CAS Name: (E)-3-(4-methoxyphenyl)-1-phenyl-2-propen-1-one
OPENEYE Name: (E)-3-(4-methoxyphenyl)-1-phenyl-prop-2-en-1-one
IUPAC Name: (E)-3-(4-methoxyphenyl)-1-phenylprop-2-en-1-one
SYSTEMATIC NAME: (E)-3-(4-methoxyphenyl)-1-phenyl-prop-2-en-1-one
MOLECULAR FORMULA: C16H14O2
MOLECULAR WEIGHT: 238.28116
SMILES: COC1=CC=C(C=C1)/C=C/C(=O)C2=CC=CC=C2
Structure:
CAS RN: 959-23-9
CAS Name: (E)-1-(4-methoxyphenyl)-3-phenyl-2-propen-1-one
OPENEYE Name: (E)-1-(4-methoxyphenyl)-3-phenyl-prop-2-en-1-one
IUPAC Name: (E)-1-(4-methoxyphenyl)-3-phenylprop-2-en-1-one
SYSTEMATIC NAME: (E)-1-(4-methoxyphenyl)-3-phenyl-prop-2-en-1-one
MOLECULAR FORMULA: C16H14O2
MOLECULAR WEIGHT: 238.28116
SMILES: COC1=CC=C(C=C1)C(=O)/C=C/C2=CC=CC=C2
Structure:
CAS RN: 18956-16-6
CAS Name: (E)-1-(2,4-dihydroxy-6-methoxyphenyl)-3-phenyl-2-propen-1-one
OPENEYE Name: (E)-1-(2,4-dihydroxy-6-methoxy-phenyl)-3-phenyl-prop-2-en-1-one
IUPAC Name: (E)-1-(2,4-dihydroxy-6-methoxyphenyl)-3-phenylprop-2-en-1-one
SYSTEMATIC NAME: (E)-1-[2-methoxy-4,6-bis(oxidanyl)phenyl]-3-phenyl-prop-2-en-1-one
MOLECULAR FORMULA: C16H14O4
MOLECULAR WEIGHT: 270.27996
SMILES: COC1=CC(=CC(=C1C(=O)/C=C/C2=CC=CC=C2)O)O
Structure:
CAS RN: 19309-14-9
CAS Name: (E)-1-(2,4-dihydroxy-6-methoxyphenyl)-3-phenyl-2-propen-1-one
OPENEYE Name: (E)-1-(2,4-dihydroxy-6-methoxy-phenyl)-3-phenyl-prop-2-en-1-one
IUPAC Name: (E)-1-(2,4-dihydroxy-6-methoxyphenyl)-3-phenylprop-2-en-1-one
SYSTEMATIC NAME: (E)-1-[2-methoxy-4,6-bis(oxidanyl)phenyl]-3-phenyl-prop-2-en-1-one
MOLECULAR FORMULA: C16H14O4
MOLECULAR WEIGHT: 270.27996
SMILES: COC1=CC(=CC(=C1C(=O)/C=C/C2=CC=CC=C2)O)O
Structure:
CAS RN: 81313-42-0
CAS Name: (3S,4R)-oxolane-3,4-diol
OPENEYE Name: (3S,4R)-tetrahydrofuran-3,4-diol
IUPAC Name: (3S,4R)-oxolane-3,4-diol
SYSTEMATIC NAME: (3S,4R)-oxolane-3,4-diol
MOLECULAR FORMULA: C4H8O3
MOLECULAR WEIGHT: 104.10452
SMILES: C1[C@H]([C@H](CO1)O)O
Structure:
CAS RN: 886-65-7
CAS Name: [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
OPENEYE Name: [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
IUPAC Name: [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
SYSTEMATIC NAME: [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
MOLECULAR FORMULA: C16H14
MOLECULAR WEIGHT: 206.28236
SMILES: C1=CC=C(C=C1)/C=C/C=C/C2=CC=CC=C2
Structure:
CAS RN: 538-81-8
CAS Name: [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
OPENEYE Name: [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
IUPAC Name: [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
SYSTEMATIC NAME: [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
MOLECULAR FORMULA: C16H14
MOLECULAR WEIGHT: 206.28236
SMILES: C1=CC=C(C=C1)/C=C/C=C/C2=CC=CC=C2
Structure:
CAS RN: 12766-12-0
CAS Name: [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
OPENEYE Name: [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
IUPAC Name: [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
SYSTEMATIC NAME: [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
MOLECULAR FORMULA: C16H14
MOLECULAR WEIGHT: 206.28236
SMILES: C1=CC=C(C=C1)/C=C/C=C/C2=CC=CC=C2
Structure:
CAS RN: 28937-85-1
CAS Name: (4aR,6aS,6bS,8aS,10S,12aS,14aS,14bS)-10-acetyloxy-2,2,6b,9,9,12a,14a-heptamethyl-1,3,4,5,6a,7,8,8a,10,11,12,13,14,14b-tetradecahydropicene-4a-carboxylic acid
OPENEYE Name: (4aR,6aS,6bS,8aS,10S,12aS,14aS,14bS)-10-acetoxy-2,2,6b,9,9,12a,14a-heptamethyl-1,3,4,5,6a,7,8,8a,10,11,12,13,14,14b-tetradecahydropicene-4a-carboxylic acid
IUPAC Name: (4aR,6aS,6bS,8aS,10S,12aS,14aS,14bS)-10-acetyloxy-2,2,6b,9,9,12a,14a-heptamethyl-1,3,4,5,6a,7,8,8a,10,11,12,13,14,14b-tetradecahydropicene-4a-carboxylic acid
SYSTEMATIC NAME: (4aR,6aS,6bS,8aS,10S,12aS,14aS,14bS)-10-acetyloxy-2,2,6b,9,9,12a,14a-heptamethyl-1,3,4,5,6a,7,8,8a,10,11,12,13,14,14b-tetradecahydropicene-4a-carboxylic acid
MOLECULAR FORMULA: C32H50O4
MOLECULAR WEIGHT: 498.737
SMILES: CC(=O)O[C@H]1CC[C@]2([C@@H]3CC[C@]4([C@@H]5CC(CC[C@]5(CC=C4[C@]3(CC[C@@H]2C1(C)C)C)C(=O)O)(C)C)C)C
Structure:
CAS RN: 77-06-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H22O6
MOLECULAR WEIGHT: 346.37438
SMILES: C[C@]12[C@@H](C=C[C@]3([C@H]1[C@@H]([C@@]45[C@@H]3CC[C@@](C4)(C(=C)C5)O)C(=O)O)OC2=O)O
Structure:
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