CAS RN: 54955-07-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H21ClN2
MOLECULAR WEIGHT: 276.80434
SMILES: CC1=CC(=C2C(=C1)C3=C4N2CCNC4CCC3)C.Cl
Structure:
CAS RN: 54955-06-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H19ClN2
MOLECULAR WEIGHT: 262.77776
SMILES: CC1=CC=CC2=C1N3CCNC4C3=C2CCC4.Cl
Structure:
CAS RN: 54954-71-1
CAS Name: 1-(3,4-dichloro-2-thiophenyl)-2-(propan-2-ylamino)ethanol
OPENEYE Name: 1-(3,4-dichloro-2-thienyl)-2-(isopropylamino)ethanol
IUPAC Name: 1-(3,4-dichlorothiophen-2-yl)-2-(propan-2-ylamino)ethanol
SYSTEMATIC NAME: 1-[3,4-bis(chloranyl)thiophen-2-yl]-2-(propan-2-ylamino)ethanol
MOLECULAR FORMULA: C9H13Cl2NOS
MOLECULAR WEIGHT: 254.17662
SMILES: CC(C)NCC(C1=C(C(=CS1)Cl)Cl)O
Structure:
CAS RN: 54954-70-0
CAS Name: 2-(tert-butylamino)-1-(3,4-dichloro-2-thiophenyl)ethanol
OPENEYE Name: 2-(tert-butylamino)-1-(3,4-dichloro-2-thienyl)ethanol
IUPAC Name: 2-(tert-butylamino)-1-(3,4-dichlorothiophen-2-yl)ethanol
SYSTEMATIC NAME: 1-[3,4-bis(chloranyl)thiophen-2-yl]-2-(tert-butylamino)ethanol
MOLECULAR FORMULA: C10H15Cl2NOS
MOLECULAR WEIGHT: 268.2032
SMILES: CC(C)(C)NCC(C1=C(C(=CS1)Cl)Cl)O
Structure:
CAS RN: 54952-09-9
CAS Name: (2S)-2-[[[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-yl]-oxomethyl]amino]-4-methylpentanoic acid
OPENEYE Name: (2S)-2-[[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-isochromane-7-carbonyl]amino]-4-methyl-pentanoic acid
IUPAC Name: (2S)-2-[[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-4-methylpentanoic acid
SYSTEMATIC NAME: (2S)-2-[[(3R)-5-chloranyl-3-methyl-8-oxidanyl-1-oxidanylidene-3,4-dihydroisochromen-7-yl]carbonylamino]-4-methyl-pentanoic acid
MOLECULAR FORMULA: C17H20ClNO6
MOLECULAR WEIGHT: 369.7968
SMILES: C[C@@H]1CC2=C(C=C(C(=C2C(=O)O1)O)C(=O)N[C@@H](CC(C)C)C(=O)O)Cl
Structure:
CAS RN: 54951-43-8
CAS Name: 1-cyclopentyl-2-[(4,4-dimethyl-1-piperazin-4-iumyl)methyl]-1,3-diphenyl-1-propanol iodide
OPENEYE Name: 2-benzyl-1-cyclopentyl-3-(4,4-dimethylpiperazin-4-ium-1-yl)-1-phenyl-propan-1-ol iodide
IUPAC Name: 2-benzyl-1-cyclopentyl-3-(4,4-dimethylpiperazin-4-ium-1-yl)-1-phenylpropan-1-ol iodide
SYSTEMATIC NAME: 1-cyclopentyl-2-[(4,4-dimethylpiperazin-4-ium-1-yl)methyl]-1,3-diphenyl-propan-1-ol iodide
MOLECULAR FORMULA: C27H39IN2O
MOLECULAR WEIGHT: 534.51583
SMILES: C[N+]1(CCN(CC1)CC(CC2=CC=CC=C2)C(C3CCCC3)(C4=CC=CC=C4)O)C.[I-]
Structure:
CAS RN: 54951-42-7
CAS Name: 1-(4,4-dimethyl-1-piperazin-4-iumyl)-4-methyl-3-phenyl-2-(phenylmethyl)-3-pentanol iodide
OPENEYE Name: 2-benzyl-1-(4,4-dimethylpiperazin-4-ium-1-yl)-4-methyl-3-phenyl-pentan-3-ol iodide
IUPAC Name: 2-benzyl-1-(4,4-dimethylpiperazin-4-ium-1-yl)-4-methyl-3-phenylpentan-3-ol iodide
SYSTEMATIC NAME: 1-(4,4-dimethylpiperazin-4-ium-1-yl)-4-methyl-3-phenyl-2-(phenylmethyl)pentan-3-ol iodide
MOLECULAR FORMULA: C25H37IN2O
MOLECULAR WEIGHT: 508.47855
SMILES: CC(C)C(C1=CC=CC=C1)(C(CC2=CC=CC=C2)CN3CC[N+](CC3)(C)C)O.[I-]
Structure:
CAS RN: 54951-40-5
CAS Name: 3-[(4,4-dimethyl-1-piperazin-4-iumyl)methyl]-2,4-diphenyl-2-butanol iodide
OPENEYE Name: 3-benzyl-4-(4,4-dimethylpiperazin-4-ium-1-yl)-2-phenyl-butan-2-ol iodide
IUPAC Name: 3-benzyl-4-(4,4-dimethylpiperazin-4-ium-1-yl)-2-phenylbutan-2-ol iodide
SYSTEMATIC NAME: 3-[(4,4-dimethylpiperazin-4-ium-1-yl)methyl]-2,4-diphenyl-butan-2-ol iodide
MOLECULAR FORMULA: C23H33IN2O
MOLECULAR WEIGHT: 480.42539
SMILES: CC(C1=CC=CC=C1)(C(CC2=CC=CC=C2)CN3CC[N+](CC3)(C)C)O.[I-]
Structure:
CAS RN: 54946-27-9
CAS Name: 1-ethyl-4-phenylpiperidine-2,6-dione
OPENEYE Name: 1-ethyl-4-phenyl-piperidine-2,6-dione
IUPAC Name: 1-ethyl-4-phenylpiperidine-2,6-dione
SYSTEMATIC NAME: 1-ethyl-4-phenyl-piperidine-2,6-dione
MOLECULAR FORMULA: C13H15NO2
MOLECULAR WEIGHT: 217.2637
SMILES: CCN1C(=O)CC(CC1=O)C2=CC=CC=C2
Structure:
CAS RN: 54946-26-8
CAS Name: 1-methyl-4-phenylpiperidine-2,6-dione
OPENEYE Name: 1-methyl-4-phenyl-piperidine-2,6-dione
IUPAC Name: 1-methyl-4-phenylpiperidine-2,6-dione
SYSTEMATIC NAME: 1-methyl-4-phenyl-piperidine-2,6-dione
MOLECULAR FORMULA: C12H13NO2
MOLECULAR WEIGHT: 203.23712
SMILES: CN1C(=O)CC(CC1=O)C2=CC=CC=C2
Structure:
CAS RN: 54943-19-0
CAS Name: 3-methyl-6-(1-oxopropyl)-1,3-benzoxazol-2-one
OPENEYE Name: 3-methyl-6-propanoyl-1,3-benzoxazol-2-one
IUPAC Name: 3-methyl-6-propanoyl-1,3-benzoxazol-2-one
SYSTEMATIC NAME: 3-methyl-6-propanoyl-1,3-benzoxazol-2-one
MOLECULAR FORMULA: C11H11NO3
MOLECULAR WEIGHT: 205.20994
SMILES: CCC(=O)C1=CC2=C(C=C1)N(C(=O)O2)C
Structure:
CAS RN: 54943-18-9
CAS Name: 1-[3-hydroxy-4-(methylamino)phenyl]-2-phenylethanone
OPENEYE Name: 1-[3-hydroxy-4-(methylamino)phenyl]-2-phenyl-ethanone
IUPAC Name: 1-[3-hydroxy-4-(methylamino)phenyl]-2-phenylethanone
SYSTEMATIC NAME: 1-[4-(methylamino)-3-oxidanyl-phenyl]-2-phenyl-ethanone
MOLECULAR FORMULA: C15H15NO2
MOLECULAR WEIGHT: 241.2851
SMILES: CNC1=C(C=C(C=C1)C(=O)CC2=CC=CC=C2)O
Structure:
CAS RN: 54941-82-1
CAS Name: (4-chlorophenyl)-(2-phenyl-1-imidazolyl)methanone
OPENEYE Name: (4-chlorophenyl)-(2-phenylimidazol-1-yl)methanone
IUPAC Name: (4-chlorophenyl)-(2-phenylimidazol-1-yl)methanone
SYSTEMATIC NAME: (4-chlorophenyl)-(2-phenylimidazol-1-yl)methanone
MOLECULAR FORMULA: C16H11ClN2O
MOLECULAR WEIGHT: 282.72434
SMILES: C1=CC=C(C=C1)C2=NC=CN2C(=O)C3=CC=C(C=C3)Cl
Structure:
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