CAS RN: 96724-45-7
CAS Name: 3-ethyl-1-(2-hydroxyethyl)-1-nitrosourea
OPENEYE Name: 3-ethyl-1-(2-hydroxyethyl)-1-nitroso-urea
IUPAC Name: 3-ethyl-1-(2-hydroxyethyl)-1-nitrosourea
SYSTEMATIC NAME: 3-ethyl-1-(2-hydroxyethyl)-1-nitroso-urea
MOLECULAR FORMULA: C5H11N3O3
MOLECULAR WEIGHT: 161.15914
SMILES: CCNC(=O)N(CCO)N=O
Structure:
CAS RN: 95230-44-7
CAS Name: ethoxy-methyl-[(1-methyl-7-quinolin-1-iumyl)oxy]phosphine iodide
OPENEYE Name: ethoxy-methyl-(1-methylquinolin-1-ium-7-yl)oxy-phosphane iodide
IUPAC Name: ethoxy-methyl-(1-methylquinolin-1-ium-7-yl)oxyphosphane iodide
SYSTEMATIC NAME: ethoxy-methyl-(1-methylquinolin-1-ium-7-yl)oxy-phosphane iodide
MOLECULAR FORMULA: C13H17INO2P
MOLECULAR WEIGHT: 377.157811
SMILES: CCOP(C)OC1=CC2=C(C=CC=[N+]2C)C=C1.[I-]
Structure:
CAS RN: 94843-50-2
CAS Name: N-(4,6-dimethyl-2-pyridinyl)benzamide
OPENEYE Name: N-(4,6-dimethyl-2-pyridyl)benzamide
IUPAC Name: N-(4,6-dimethylpyridin-2-yl)benzamide
SYSTEMATIC NAME: N-(4,6-dimethylpyridin-2-yl)benzamide
MOLECULAR FORMULA: C14H14N2O
MOLECULAR WEIGHT: 226.27376
SMILES: CC1=CC(=NC(=C1)NC(=O)C2=CC=CC=C2)C
Structure:
CAS RN: 94659-41-3
CAS Name: 1,4-dichloro-2-(2,5-dichloro-4-ethylsulfonylphenyl)-5-ethylsulfonylbenzene
OPENEYE Name: 1,4-dichloro-2-(2,5-dichloro-4-ethylsulfonyl-phenyl)-5-ethylsulfonyl-benzene
IUPAC Name: 1,4-dichloro-2-(2,5-dichloro-4-ethylsulfonylphenyl)-5-ethylsulfonylbenzene
SYSTEMATIC NAME: 1-[2,5-bis(chloranyl)-4-ethylsulfonyl-phenyl]-2,5-bis(chloranyl)-4-ethylsulfonyl-benzene
MOLECULAR FORMULA: C16H14Cl4O4S2
MOLECULAR WEIGHT: 476.22196
SMILES: CCS(=O)(=O)C1=C(C=C(C(=C1)Cl)C2=CC(=C(C=C2Cl)S(=O)(=O)CC)Cl)Cl
Structure:
CAS RN: 94631-87-5
CAS Name: 4-[2-(hydroxymethyl)-4-methoxyanilino]phenol
OPENEYE Name: 4-[2-(hydroxymethyl)-4-methoxy-anilino]phenol
IUPAC Name: 4-[2-(hydroxymethyl)-4-methoxyanilino]phenol
SYSTEMATIC NAME: 4-[[2-(hydroxymethyl)-4-methoxy-phenyl]amino]phenol
MOLECULAR FORMULA: C14H15NO3
MOLECULAR WEIGHT: 245.2738
SMILES: COC1=CC(=C(C=C1)NC2=CC=C(C=C2)O)CO
Structure:
CAS RN: 94357-79-6
CAS Name: 4-(1-propyl-3-pyrrolidinyl)benzene-1,2-diol hydrobromide
OPENEYE Name: 4-(1-propylpyrrolidin-3-yl)benzene-1,2-diol hydrobromide
IUPAC Name: 4-(1-propylpyrrolidin-3-yl)benzene-1,2-diol hydrobromide
SYSTEMATIC NAME: 4-(1-propylpyrrolidin-3-yl)benzene-1,2-diol hydrobromide
MOLECULAR FORMULA: C13H20BrNO2
MOLECULAR WEIGHT: 302.2074
SMILES: CCCN1CCC(C1)C2=CC(=C(C=C2)O)O.Br
Structure:
CAS RN: 99605-71-7
CAS Name: (2R)-2-amino-2-(4-fluorophenyl)acetic acid
OPENEYE Name: (2R)-2-amino-2-(4-fluorophenyl)acetic acid
IUPAC Name: (2R)-2-amino-2-(4-fluorophenyl)acetic acid
SYSTEMATIC NAME: (2R)-2-azanyl-2-(4-fluorophenyl)ethanoic acid
MOLECULAR FORMULA: C8H8FNO2
MOLECULAR WEIGHT: 169.153023
SMILES: C1=CC(=CC=C1[C@H](C(=O)O)N)F
Structure:
CAS RN: 93939-74-3
CAS Name: (2R)-2-amino-2-(4-fluorophenyl)acetic acid
OPENEYE Name: (2R)-2-amino-2-(4-fluorophenyl)acetic acid
IUPAC Name: (2R)-2-amino-2-(4-fluorophenyl)acetic acid
SYSTEMATIC NAME: (2R)-2-azanyl-2-(4-fluorophenyl)ethanoic acid
MOLECULAR FORMULA: C8H8FNO2
MOLECULAR WEIGHT: 169.153023
SMILES: C1=CC(=CC=C1[C@H](C(=O)O)N)F
Structure:
CAS RN: 93768-40-2
CAS Name: 7-chloro-6-hydroxy-5H-phenazin-1-one
OPENEYE Name: 7-chloro-6-hydroxy-5H-phenazin-1-one
IUPAC Name: 7-chloro-6-hydroxy-5H-phenazin-1-one
SYSTEMATIC NAME: 7-chloranyl-6-oxidanyl-5H-phenazin-1-one
MOLECULAR FORMULA: C12H7ClN2O2
MOLECULAR WEIGHT: 246.64918
SMILES: C1=CC(=O)C2=NC3=C(C(=C(C=C3)Cl)O)NC2=C1
Structure:
CAS RN: 93490-31-4
CAS Name: 4-chloro-6-methoxy-1H-indole
OPENEYE Name: 4-chloro-6-methoxy-1H-indole
IUPAC Name: 4-chloro-6-methoxy-1H-indole
SYSTEMATIC NAME: 4-chloranyl-6-methoxy-1H-indole
MOLECULAR FORMULA: C9H8ClNO
MOLECULAR WEIGHT: 181.61892
SMILES: COC1=CC(=C2C=CNC2=C1)Cl
Structure:
CAS RN: 93065-08-8
CAS Name: hepta-5,6-diene-1,4-diamine
OPENEYE Name: hepta-5,6-diene-1,4-diamine
IUPAC Name: hepta-5,6-diene-1,4-diamine
SYSTEMATIC NAME: hepta-5,6-diene-1,4-diamine
MOLECULAR FORMULA: C7H14N2
MOLECULAR WEIGHT: 126.19946
SMILES: C=C=CC(CCCN)N
Structure:
CAS RN: 92575-16-1
CAS Name: 7-amino-7-methyl-6,8-dihydro-5H-naphthalene-2,3-diol
OPENEYE Name: 2-amino-2-methyl-tetralin-6,7-diol
IUPAC Name: 7-amino-7-methyl-6,8-dihydro-5H-naphthalene-2,3-diol
SYSTEMATIC NAME: 7-azanyl-7-methyl-6,8-dihydro-5H-naphthalene-2,3-diol
MOLECULAR FORMULA: C11H15NO2
MOLECULAR WEIGHT: 193.2423
SMILES: CC1(CCC2=CC(=C(C=C2C1)O)O)N
Structure:
CAS RN: 98296-23-2
CAS Name: 1-[2-hydroxy-3-propyl-4-[6-(2H-tetrazol-5-yl)hexoxy]phenyl]ethanone
OPENEYE Name: 1-[2-hydroxy-3-propyl-4-[6-(2H-tetrazol-5-yl)hexoxy]phenyl]ethanone
IUPAC Name: 1-[2-hydroxy-3-propyl-4-[6-(2H-tetrazol-5-yl)hexoxy]phenyl]ethanone
SYSTEMATIC NAME: 1-[2-oxidanyl-3-propyl-4-[6-(2H-1,2,3,4-tetrazol-5-yl)hexoxy]phenyl]ethanone
MOLECULAR FORMULA: C18H26N4O3
MOLECULAR WEIGHT: 346.42404
SMILES: CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCCC2=NNN=N2
Structure:
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