CAS RN: 61325-82-4
CAS Name: 7-fluoro-4-(4-methyl-1-piperazinyl)-5H-thieno[2,3-c][1,5]benzodiazepine
OPENEYE Name: 7-fluoro-4-(4-methylpiperazin-1-yl)-5H-thieno[2,3-c][1,5]benzodiazepine
IUPAC Name: 7-fluoro-4-(4-methylpiperazin-1-yl)-5H-thieno[2,3-c][1,5]benzodiazepine
SYSTEMATIC NAME: 7-fluoranyl-4-(4-methylpiperazin-1-yl)-5H-thieno[2,3-c][1,5]benzodiazepine
MOLECULAR FORMULA: C16H17FN4S
MOLECULAR WEIGHT: 316.396383
SMILES: CN1CCN(CC1)C2=C3C(=NC4=C(N2)C=C(C=C4)F)C=CS3
Structure:
CAS RN: 521-54-0
CAS Name: (1S,2S,3R)-1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2,3-dimethyl-1,2,3,4-tetrahydronaphthalene
OPENEYE Name: (1S,2S,3R)-1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2,3-dimethyl-tetralin
IUPAC Name: (1S,2S,3R)-1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2,3-dimethyl-1,2,3,4-tetrahydronaphthalene
SYSTEMATIC NAME: (1S,2S,3R)-1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2,3-dimethyl-1,2,3,4-tetrahydronaphthalene
MOLECULAR FORMULA: C22H28O4
MOLECULAR WEIGHT: 356.45532
SMILES: C[C@@H]1CC2=CC(=C(C=C2[C@@H]([C@H]1C)C3=CC(=C(C=C3)OC)OC)OC)OC
Structure:
CAS RN: 25332-13-2
CAS Name: 3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N,2-trimethyl-1-propanamine; methanesulfonic acid
OPENEYE Name: 3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N,2-trimethyl-propan-1-amine; methanesulfonic acid
IUPAC Name: 3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N,2-trimethylpropan-1-amine; methanesulfonic acid
SYSTEMATIC NAME: 3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N,2-trimethyl-propan-1-amine; methanesulfonic acid
MOLECULAR FORMULA: C21H30N2O3S
MOLECULAR WEIGHT: 390.5395
SMILES: CC(CN1C2=CC=CC=C2CCC3=CC=CC=C31)CN(C)C.CS(=O)(=O)O
Structure:
CAS RN: 72601-82-2
CAS Name: 4-methyl-7-[[(2R,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxy]-1-benzopyran-2-one
OPENEYE Name: 4-methyl-7-[(2R,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-chromen-2-one
IUPAC Name: 4-methyl-7-[(2R,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-2-one
SYSTEMATIC NAME: 4-methyl-7-[(2R,3S,4R,5S,6S)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-chromen-2-one
MOLECULAR FORMULA: C16H18O7
MOLECULAR WEIGHT: 322.30992
SMILES: C[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)OC2=CC3=C(C=C2)C(=CC(=O)O3)C)O)O)O
Structure:
CAS RN: 58757-61-2
CAS Name: N-[(2,4,6-trimethylphenyl)methyl]-2-heptanamine
OPENEYE Name: N-[(2,4,6-trimethylphenyl)methyl]heptan-2-amine
IUPAC Name: N-[(2,4,6-trimethylphenyl)methyl]heptan-2-amine
SYSTEMATIC NAME: N-[(2,4,6-trimethylphenyl)methyl]heptan-2-amine
MOLECULAR FORMULA: C17H29N
MOLECULAR WEIGHT: 247.41886
SMILES: CCCCCC(C)NCC1=C(C=C(C=C1C)C)C
Structure:
CAS RN: 555-91-9
CAS Name: zinc diphenoxide
OPENEYE Name: zinc diphenoxide
IUPAC Name: zinc diphenoxide
SYSTEMATIC NAME: zinc diphenoxide
MOLECULAR FORMULA: C12H10O2Zn
MOLECULAR WEIGHT: 251.6156
SMILES: C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].[Zn+2]
Structure:
CAS RN: 590-94-3
CAS Name: 1-isocyano-2-methylpropane
OPENEYE Name: 1-isocyano-2-methyl-propane
IUPAC Name: 1-isocyano-2-methylpropane
SYSTEMATIC NAME: 1-isocyano-2-methyl-propane
MOLECULAR FORMULA: C5H9N
MOLECULAR WEIGHT: 83.13166
SMILES: CC(C)C[N+]#[C-]
Structure:
CAS RN: 3476-42-4
CAS Name: [2-hydroxy-3-(1-oxododecoxy)propyl] 2-(trimethylammonio)ethyl phosphate
OPENEYE Name: (3-dodecanoyloxy-2-hydroxy-propyl) 2-(trimethylammonio)ethyl phosphate
IUPAC Name: (3-dodecanoyloxy-2-hydroxypropyl) 2-(trimethylazaniumyl)ethyl phosphate
SYSTEMATIC NAME: (3-dodecanoyloxy-2-oxidanyl-propyl) 2-(trimethylazaniumyl)ethyl phosphate
MOLECULAR FORMULA: C20H42NO7P
MOLECULAR WEIGHT: 439.523741
SMILES: CCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)O
Structure:
CAS RN: 13699-45-1
CAS Name: [2-hydroxy-3-(1-oxotetradecoxy)propyl] 2-(trimethylammonio)ethyl phosphate
OPENEYE Name: (2-hydroxy-3-tetradecanoyloxy-propyl) 2-(trimethylammonio)ethyl phosphate
IUPAC Name: (2-hydroxy-3-tetradecanoyloxypropyl) 2-(trimethylazaniumyl)ethyl phosphate
SYSTEMATIC NAME: (2-oxidanyl-3-tetradecanoyloxy-propyl) 2-(trimethylazaniumyl)ethyl phosphate
MOLECULAR FORMULA: C22H46NO7P
MOLECULAR WEIGHT: 467.576901
SMILES: CCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)O
Structure:
CAS RN: 66760-21-2
CAS Name: 3,4,5-trimethoxybenzoic acid 2-(1,2,4-triazol-1-yl)ethyl ester
OPENEYE Name: 2-(1,2,4-triazol-1-yl)ethyl 3,4,5-trimethoxybenzoate
IUPAC Name: 2-(1,2,4-triazol-1-yl)ethyl 3,4,5-trimethoxybenzoate
SYSTEMATIC NAME: 2-(1,2,4-triazol-1-yl)ethyl 3,4,5-trimethoxybenzoate
MOLECULAR FORMULA: C14H17N3O5
MOLECULAR WEIGHT: 307.30188
SMILES: COC1=CC(=CC(=C1OC)OC)C(=O)OCCN2C=NC=N2
Structure:
CAS RN: 61464-03-7
CAS Name: trimethoxy(3-phenoxypropyl)silane
OPENEYE Name: trimethoxy(3-phenoxypropyl)silane
IUPAC Name: trimethoxy(3-phenoxypropyl)silane
SYSTEMATIC NAME: trimethoxy(3-phenoxypropyl)silane
MOLECULAR FORMULA: C12H20O4Si
MOLECULAR WEIGHT: 256.3703
SMILES: CO[Si](CCCOC1=CC=CC=C1)(OC)OC
Structure:
CAS RN: 69284-78-2
CAS Name: trimethoxy-[3-(2-thiiranylmethoxy)propyl]silane
OPENEYE Name: trimethoxy-[3-(thiiran-2-ylmethoxy)propyl]silane
IUPAC Name: trimethoxy-[3-(thiiran-2-ylmethoxy)propyl]silane
SYSTEMATIC NAME: trimethoxy-[3-(thiiran-2-ylmethoxy)propyl]silane
MOLECULAR FORMULA: C9H20O4SSi
MOLECULAR WEIGHT: 252.4032
SMILES: CO[Si](CCCOCC1CS1)(OC)OC
Structure:
CAS RN: 83038-82-8
CAS Name: trimethoxy(tetradecyl)silane
OPENEYE Name: trimethoxy(tetradecyl)silane
IUPAC Name: trimethoxy(tetradecyl)silane
SYSTEMATIC NAME: trimethoxy(tetradecyl)silane
MOLECULAR FORMULA: C17H38O3Si
MOLECULAR WEIGHT: 318.56732
SMILES: CCCCCCCCCCCCCC[Si](OC)(OC)OC
Structure:
CAS RN: 128917-83-9
CAS Name: 3-(decyl-methyl-octylammonio)-2-hydroxy-1-propanesulfonate
OPENEYE Name: 3-(decyl-methyl-octyl-ammonio)-2-hydroxy-propane-1-sulfonate
IUPAC Name: 3-(decyl-methyl-octylazaniumyl)-2-hydroxypropane-1-sulfonate
SYSTEMATIC NAME: 3-(decyl-methyl-octyl-azaniumyl)-2-oxidanyl-propane-1-sulfonate
MOLECULAR FORMULA: C22H47NO4S
MOLECULAR WEIGHT: 421.67788
SMILES: CCCCCCCCCC[N+](C)(CCCCCCCC)CC(CS(=O)(=O)[O-])O
Structure:
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