CAS RN: 50293-90-8
CAS Name: 4-[(1R)-2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol hydrochloride
OPENEYE Name: 4-[(1R)-2-(tert-butylamino)-1-hydroxy-ethyl]-2-(hydroxymethyl)phenol hydrochloride
IUPAC Name: 4-[(1R)-2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol hydrochloride
SYSTEMATIC NAME: 4-[(1R)-2-(tert-butylamino)-1-oxidanyl-ethyl]-2-(hydroxymethyl)phenol hydrochloride
MOLECULAR FORMULA: C13H22ClNO3
MOLECULAR WEIGHT: 275.77168
SMILES: CC(C)(C)NC[C@@H](C1=CC(=C(C=C1)O)CO)O.Cl
Structure:
CAS RN: 52019-05-3
CAS Name: 4-[(1R)-2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol hydrochloride
OPENEYE Name: 4-[(1R)-2-(tert-butylamino)-1-hydroxy-ethyl]-2-(hydroxymethyl)phenol hydrochloride
IUPAC Name: 4-[(1R)-2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol hydrochloride
SYSTEMATIC NAME: 4-[(1R)-2-(tert-butylamino)-1-oxidanyl-ethyl]-2-(hydroxymethyl)phenol hydrochloride
MOLECULAR FORMULA: C13H22ClNO3
MOLECULAR WEIGHT: 275.77168
SMILES: CC(C)(C)NC[C@@H](C1=CC(=C(C=C1)O)CO)O.Cl
Structure:
CAS RN: 34391-04-3
CAS Name: 4-[(1R)-2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol
OPENEYE Name: 4-[(1R)-2-(tert-butylamino)-1-hydroxy-ethyl]-2-(hydroxymethyl)phenol
IUPAC Name: 4-[(1R)-2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol
SYSTEMATIC NAME: 4-[(1R)-2-(tert-butylamino)-1-oxidanyl-ethyl]-2-(hydroxymethyl)phenol
MOLECULAR FORMULA: C13H21NO3
MOLECULAR WEIGHT: 239.31074
SMILES: CC(C)(C)NC[C@@H](C1=CC(=C(C=C1)O)CO)O
Structure:
CAS RN: 220127-57-1
CAS Name: methanesulfonic acid; 4-[(4-methyl-1-piperazinyl)methyl]-N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]benzamide
OPENEYE Name: methanesulfonic acid; 4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]benzamide
IUPAC Name: methanesulfonic acid; 4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide
SYSTEMATIC NAME: methanesulfonic acid; 4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide
MOLECULAR FORMULA: C30H35N7O4S
MOLECULAR WEIGHT: 589.7084
SMILES: CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)C)NC4=NC=CC(=N4)C5=CN=CC=C5.CS(=O)(=O)O
Structure:
CAS RN: 134855-87-1
CAS Name: 4-(1-aminoethyl)phenol
OPENEYE Name: 4-(1-aminoethyl)phenol
IUPAC Name: 4-(1-aminoethyl)phenol
SYSTEMATIC NAME: 4-(1-azanylethyl)phenol
MOLECULAR FORMULA: C8H11NO
MOLECULAR WEIGHT: 137.17904
SMILES: CC(C1=CC=C(C=C1)O)N
Structure:
CAS RN: 113504-93-1
CAS Name: 5-isothiocyanato-1,3-benzodioxole
OPENEYE Name: 5-isothiocyanato-1,3-benzodioxole
IUPAC Name: 5-isothiocyanato-1,3-benzodioxole
SYSTEMATIC NAME: 5-isothiocyanato-1,3-benzodioxole
MOLECULAR FORMULA: C8H5NO2S
MOLECULAR WEIGHT: 179.1958
SMILES: C1OC2=C(O1)C=C(C=C2)N=C=S
Structure:
CAS RN: 99780-98-0
CAS Name: 1-hexadecan-2-ylnaphthalene
OPENEYE Name: 1-(1-methylpentadecyl)naphthalene
IUPAC Name: 1-hexadecan-2-ylnaphthalene
SYSTEMATIC NAME: 1-hexadecan-2-ylnaphthalene
MOLECULAR FORMULA: C26H40
MOLECULAR WEIGHT: 352.5958
SMILES: CCCCCCCCCCCCCCC(C)C1=CC=CC2=CC=CC=C21
Structure:
CAS RN: 85118-06-5
CAS Name: (2,5-difluorophenyl)methanamine
OPENEYE Name: (2,5-difluorophenyl)methanamine
IUPAC Name: (2,5-difluorophenyl)methanamine
SYSTEMATIC NAME: [2,5-bis(fluoranyl)phenyl]methanamine
MOLECULAR FORMULA: C7H7F2N
MOLECULAR WEIGHT: 143.133986
SMILES: C1=CC(=C(C=C1F)CN)F
Structure:
CAS RN: 85118-02-1
CAS Name: 2,4-difluorobenzamide
OPENEYE Name: 2,4-difluorobenzamide
IUPAC Name: 2,4-difluorobenzamide
SYSTEMATIC NAME: 2,4-bis(fluoranyl)benzamide
MOLECULAR FORMULA: C7H5F2NO
MOLECULAR WEIGHT: 157.117506
SMILES: C1=CC(=C(C=C1F)F)C(=O)N
Structure:
CAS RN: 85068-33-3
CAS Name: 2-[3,5-bis(trifluoromethyl)phenyl]acetic acid
OPENEYE Name: 2-[3,5-bis(trifluoromethyl)phenyl]acetic acid
IUPAC Name: 2-[3,5-bis(trifluoromethyl)phenyl]acetic acid
SYSTEMATIC NAME: 2-[3,5-bis(trifluoromethyl)phenyl]ethanoic acid
MOLECULAR FORMULA: C10H6F6O2
MOLECULAR WEIGHT: 272.143859
SMILES: C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CC(=O)O
Structure:
CAS RN: 91133-68-5
CAS Name: 1-(2,4-difluorophenyl)-1-propanone
OPENEYE Name: 1-(2,4-difluorophenyl)propan-1-one
IUPAC Name: 1-(2,4-difluorophenyl)propan-1-one
SYSTEMATIC NAME: 1-[2,4-bis(fluoranyl)phenyl]propan-1-one
MOLECULAR FORMULA: C9H8F2O
MOLECULAR WEIGHT: 170.156026
SMILES: CCC(=O)C1=C(C=C(C=C1)F)F
Structure:
CAS RN: 85068-28-6
CAS Name: 2-(2,6-difluorophenyl)acetic acid
OPENEYE Name: 2-(2,6-difluorophenyl)acetic acid
IUPAC Name: 2-(2,6-difluorophenyl)acetic acid
SYSTEMATIC NAME: 2-[2,6-bis(fluoranyl)phenyl]ethanoic acid
MOLECULAR FORMULA: C8H6F2O2
MOLECULAR WEIGHT: 172.128846
SMILES: C1=CC(=C(C(=C1)F)CC(=O)O)F
Structure:
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