CAS RN: 1162-60-3
CAS Name: 17-ethynyl-17-hydroxy-7,13-dimethyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
OPENEYE Name: 17-ethynyl-17-hydroxy-7,13-dimethyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
IUPAC Name: 17-ethynyl-17-hydroxy-7,13-dimethyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
SYSTEMATIC NAME: 17-ethynyl-7,13-dimethyl-17-oxidanyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
MOLECULAR FORMULA: C21H28O2
MOLECULAR WEIGHT: 312.44582
SMILES: CC1CC2=CC(=O)CCC2C3C1C4CCC(C4(CC3)C)(C#C)O
Structure:
CAS RN: 19896-18-5
CAS Name: 2,2-dichloro-N-hydroxy-N-(2-phenylmethoxyphenyl)acetamide
OPENEYE Name: N-(2-benzyloxyphenyl)-2,2-dichloro-N-hydroxy-acetamide
IUPAC Name: 2,2-dichloro-N-hydroxy-N-(2-phenylmethoxyphenyl)acetamide
SYSTEMATIC NAME: 2,2-bis(chloranyl)-N-oxidanyl-N-(2-phenylmethoxyphenyl)ethanamide
MOLECULAR FORMULA: C15H13Cl2NO3
MOLECULAR WEIGHT: 326.17462
SMILES: C1=CC=C(C=C1)COC2=CC=CC=C2N(C(=O)C(Cl)Cl)O
Structure:
CAS RN: 34288-10-3
CAS Name: N-(2,3-dioxo-1,4-benzoxazin-4-yl)-2,2,2-trifluoroacetamide
OPENEYE Name: N-(2,3-dioxo-1,4-benzoxazin-4-yl)-2,2,2-trifluoro-acetamide
IUPAC Name: N-(2,3-dioxo-1,4-benzoxazin-4-yl)-2,2,2-trifluoroacetamide
SYSTEMATIC NAME: N-[2,3-bis(oxidanylidene)-1,4-benzoxazin-4-yl]-2,2,2-tris(fluoranyl)ethanamide
MOLECULAR FORMULA: C10H5F3N2O4
MOLECULAR WEIGHT: 274.15291
SMILES: C1=CC=C2C(=C1)N(C(=O)C(=O)O2)NC(=O)C(F)(F)F
Structure:
CAS RN: 96911-75-0
CAS Name: 5-methoxy-4,7-phenanthroline
OPENEYE Name: 5-methoxy-4,7-phenanthroline
IUPAC Name: 5-methoxy-4,7-phenanthroline
SYSTEMATIC NAME: 5-methoxy-4,7-phenanthroline
MOLECULAR FORMULA: C13H10N2O
MOLECULAR WEIGHT: 210.2313
SMILES: COC1=C2C(=C3C=CC=NC3=C1)C=CC=N2
Structure:
CAS RN: 4198-18-9
CAS Name: 1-(5-oxo-2H-furan-2-yl)pyrimidine-2,4-dione
OPENEYE Name: 1-(5-oxo-2H-furan-2-yl)pyrimidine-2,4-dione
IUPAC Name: 1-(5-oxo-2H-furan-2-yl)pyrimidine-2,4-dione
SYSTEMATIC NAME: 1-(5-oxidanylidene-2H-furan-2-yl)pyrimidine-2,4-dione
MOLECULAR FORMULA: C8H6N2O4
MOLECULAR WEIGHT: 194.14424
SMILES: C1=CC(=O)OC1N2C=CC(=O)NC2=O
Structure:
CAS RN: 51537-81-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H21NO5
MOLECULAR WEIGHT: 331.36304
SMILES: COC12C[C@]34CCCN3CC(O1)C5=CC6=C(C=C5[C@@H]4[C@@H]2O)OCO6
Structure:
CAS RN: 49686-55-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H21NO5
MOLECULAR WEIGHT: 331.36304
SMILES: COC1=C[C@]23CCCN2C[C@@H](C4=CC5=C(C=C4[C@@H]3[C@@H]1O)OCO5)O
Structure:
CAS RN: 36804-95-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C28H37NO8
MOLECULAR WEIGHT: 515.59528
SMILES: CC(C)CC[C@@](CC(=O)OC)(C(=O)O[C@H]1[C@H]2C3=CC4=C(C=C3CCN5[C@@]2(CCC5)C=C1OC)OCO4)O
Structure:
CAS RN: 59504-29-9
CAS Name: 5-chloro-2-(1-pyrrolidinyl)aniline
OPENEYE Name: 5-chloro-2-pyrrolidin-1-yl-aniline
IUPAC Name: 5-chloro-2-pyrrolidin-1-ylaniline
SYSTEMATIC NAME: 5-chloranyl-2-pyrrolidin-1-yl-aniline
MOLECULAR FORMULA: C10H13ClN2
MOLECULAR WEIGHT: 196.67662
SMILES: C1CCN(C1)C2=C(C=C(C=C2)Cl)N
Structure:
CAS RN: 58749-47-6
CAS Name: 5-hydroxy-4-methoxy-2-nitrobenzaldehyde
OPENEYE Name: 5-hydroxy-4-methoxy-2-nitro-benzaldehyde
IUPAC Name: 5-hydroxy-4-methoxy-2-nitrobenzaldehyde
SYSTEMATIC NAME: 4-methoxy-2-nitro-5-oxidanyl-benzaldehyde
MOLECULAR FORMULA: C8H7NO5
MOLECULAR WEIGHT: 197.14488
SMILES: COC1=C(C=C(C(=C1)[N+](=O)[O-])C=O)O
Structure:
CAS RN: 1560-31-2
CAS Name: phenyl(1-piperidinyl)methanethione
OPENEYE Name: phenyl(1-piperidyl)methanethione
IUPAC Name: phenyl(piperidin-1-yl)methanethione
SYSTEMATIC NAME: phenyl(piperidin-1-yl)methanethione
MOLECULAR FORMULA: C12H15NS
MOLECULAR WEIGHT: 205.3192
SMILES: C1CCN(CC1)C(=S)C2=CC=CC=C2
Structure:
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