CAS RN: 42840-07-3
CAS Name: 4-methoxy-3-(1-piperidinylmethyl)-9-xanthenone hydrochloride
OPENEYE Name: 4-methoxy-3-(1-piperidylmethyl)xanthen-9-one hydrochloride
IUPAC Name: 4-methoxy-3-(piperidin-1-ylmethyl)xanthen-9-one hydrochloride
SYSTEMATIC NAME: 4-methoxy-3-(piperidin-1-ylmethyl)xanthen-9-one hydrochloride
MOLECULAR FORMULA: C20H22ClNO3
MOLECULAR WEIGHT: 359.84658
SMILES: COC1=C(C=CC2=C1OC3=CC=CC=C3C2=O)CN4CCCCC4.Cl
Structure:
CAS RN: 42840-06-2
CAS Name: 3-(diethylaminomethyl)-4-methoxy-9-xanthenone hydrochloride
OPENEYE Name: 3-(diethylaminomethyl)-4-methoxy-xanthen-9-one hydrochloride
IUPAC Name: 3-(diethylaminomethyl)-4-methoxyxanthen-9-one hydrochloride
SYSTEMATIC NAME: 3-(diethylaminomethyl)-4-methoxy-xanthen-9-one hydrochloride
MOLECULAR FORMULA: C19H22ClNO3
MOLECULAR WEIGHT: 347.83588
SMILES: CCN(CC)CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3O2)OC.Cl
Structure:
CAS RN: 69484-11-3
CAS Name: 3-[(dimethylamino)methyl]-4-methoxy-9-xanthenone
OPENEYE Name: 3-[(dimethylamino)methyl]-4-methoxy-xanthen-9-one
IUPAC Name: 3-[(dimethylamino)methyl]-4-methoxyxanthen-9-one
SYSTEMATIC NAME: 3-[(dimethylamino)methyl]-4-methoxy-xanthen-9-one
MOLECULAR FORMULA: C17H17NO3
MOLECULAR WEIGHT: 283.32178
SMILES: CN(C)CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3O2)OC
Structure:
CAS RN: 42840-05-1
CAS Name: 3-[(dimethylamino)methyl]-4-methoxy-9-xanthenone hydrochloride
OPENEYE Name: 3-[(dimethylamino)methyl]-4-methoxy-xanthen-9-one hydrochloride
IUPAC Name: 3-[(dimethylamino)methyl]-4-methoxyxanthen-9-one hydrochloride
SYSTEMATIC NAME: 3-[(dimethylamino)methyl]-4-methoxy-xanthen-9-one hydrochloride
MOLECULAR FORMULA: C17H18ClNO3
MOLECULAR WEIGHT: 319.78272
SMILES: CN(C)CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3O2)OC.Cl
Structure:
CAS RN: 42839-75-8
CAS Name: 1-bromo-3-methoxy-4-(4-morpholinylmethyl)-9-fluorenone
OPENEYE Name: 1-bromo-3-methoxy-4-(morpholinomethyl)fluoren-9-one
IUPAC Name: 1-bromo-3-methoxy-4-(morpholin-4-ylmethyl)fluoren-9-one
SYSTEMATIC NAME: 1-bromanyl-3-methoxy-4-(morpholin-4-ylmethyl)fluoren-9-one
MOLECULAR FORMULA: C19H18BrNO3
MOLECULAR WEIGHT: 388.25512
SMILES: COC1=CC(=C2C(=C1CN3CCOCC3)C4=CC=CC=C4C2=O)Br
Structure:
CAS RN: 42839-74-7
CAS Name: 1-bromo-3-methoxy-4-(1-piperidinylmethyl)-9-fluorenone
OPENEYE Name: 1-bromo-3-methoxy-4-(1-piperidylmethyl)fluoren-9-one
IUPAC Name: 1-bromo-3-methoxy-4-(piperidin-1-ylmethyl)fluoren-9-one
SYSTEMATIC NAME: 1-bromanyl-3-methoxy-4-(piperidin-1-ylmethyl)fluoren-9-one
MOLECULAR FORMULA: C20H20BrNO2
MOLECULAR WEIGHT: 386.2823
SMILES: COC1=CC(=C2C(=C1CN3CCCCC3)C4=CC=CC=C4C2=O)Br
Structure:
CAS RN: 42837-63-8
CAS Name: 1-(5-amino-1,2,4-oxadiazol-3-yl)-1-butanone
OPENEYE Name: 1-(5-amino-1,2,4-oxadiazol-3-yl)butan-1-one
IUPAC Name: 1-(5-amino-1,2,4-oxadiazol-3-yl)butan-1-one
SYSTEMATIC NAME: 1-(5-azanyl-1,2,4-oxadiazol-3-yl)butan-1-one
MOLECULAR FORMULA: C6H9N3O2
MOLECULAR WEIGHT: 155.15456
SMILES: CCCC(=O)C1=NOC(=N1)N
Structure:
CAS RN: 42837-62-7
CAS Name: 1-(5-amino-1,2,4-oxadiazol-3-yl)ethanone
OPENEYE Name: 1-(5-amino-1,2,4-oxadiazol-3-yl)ethanone
IUPAC Name: 1-(5-amino-1,2,4-oxadiazol-3-yl)ethanone
SYSTEMATIC NAME: 1-(5-azanyl-1,2,4-oxadiazol-3-yl)ethanone
MOLECULAR FORMULA: C4H5N3O2
MOLECULAR WEIGHT: 127.1014
SMILES: CC(=O)C1=NOC(=N1)N
Structure:
CAS RN: 42837-61-6
CAS Name: (5-amino-1,2,4-oxadiazol-3-yl)-phenylmethanone
OPENEYE Name: (5-amino-1,2,4-oxadiazol-3-yl)-phenyl-methanone
IUPAC Name: (5-amino-1,2,4-oxadiazol-3-yl)-phenylmethanone
SYSTEMATIC NAME: (5-azanyl-1,2,4-oxadiazol-3-yl)-phenyl-methanone
MOLECULAR FORMULA: C9H7N3O2
MOLECULAR WEIGHT: 189.17078
SMILES: C1=CC=C(C=C1)C(=O)C2=NOC(=N2)N
Structure:
CAS RN: 42824-39-5
CAS Name: 2-[4-[1,1-bis(4-methoxyphenyl)but-1-en-2-yl]phenoxy]-N,N-diethylethanamine hydrochloride
OPENEYE Name: 2-[4-[1-[bis(4-methoxyphenyl)methylene]propyl]phenoxy]-N,N-diethyl-ethanamine hydrochloride
IUPAC Name: 2-[4-[1,1-bis(4-methoxyphenyl)but-1-en-2-yl]phenoxy]-N,N-diethylethanamine hydrochloride
SYSTEMATIC NAME: 2-[4-[1,1-bis(4-methoxyphenyl)but-1-en-2-yl]phenoxy]-N,N-diethyl-ethanamine hydrochloride
MOLECULAR FORMULA: C30H38ClNO3
MOLECULAR WEIGHT: 496.08062
SMILES: CCC(=C(C1=CC=C(C=C1)OC)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OCCN(CC)CC.Cl
Structure:
CAS RN: 42824-30-6
CAS Name: 2-[2-[2-[4-[2-(dimethylamino)ethoxy]phenyl]ethoxy]-4-methoxyphenyl]-1-(4-methoxyphenyl)ethanol hydrochloride
OPENEYE Name: 2-[2-[2-[4-[2-(dimethylamino)ethoxy]phenyl]ethoxy]-4-methoxy-phenyl]-1-(4-methoxyphenyl)ethanol hydrochloride
IUPAC Name: 2-[2-[2-[4-[2-(dimethylamino)ethoxy]phenyl]ethoxy]-4-methoxyphenyl]-1-(4-methoxyphenyl)ethanol hydrochloride
SYSTEMATIC NAME: 2-[2-[2-[4-[2-(dimethylamino)ethoxy]phenyl]ethoxy]-4-methoxy-phenyl]-1-(4-methoxyphenyl)ethanol hydrochloride
MOLECULAR FORMULA: C28H36ClNO5
MOLECULAR WEIGHT: 502.04214
SMILES: CN(C)CCOC1=CC=C(C=C1)CCOC2=C(C=CC(=C2)OC)CC(C3=CC=C(C=C3)OC)O.Cl
Structure:
CAS RN: 42818-60-0
CAS Name: 1-[3-amino-5-(trifluoromethyl)phenyl]ethanol
OPENEYE Name: 1-[3-amino-5-(trifluoromethyl)phenyl]ethanol
IUPAC Name: 1-[3-amino-5-(trifluoromethyl)phenyl]ethanol
SYSTEMATIC NAME: 1-[3-azanyl-5-(trifluoromethyl)phenyl]ethanol
MOLECULAR FORMULA: C9H10F3NO
MOLECULAR WEIGHT: 205.17701
SMILES: CC(C1=CC(=CC(=C1)N)C(F)(F)F)O
Structure:
CAS RN: 42796-29-2
CAS Name: 1-(3-phenoxy-3-phenylpropyl)pyrrolidine
OPENEYE Name: 1-(3-phenoxy-3-phenyl-propyl)pyrrolidine
IUPAC Name: 1-(3-phenoxy-3-phenylpropyl)pyrrolidine
SYSTEMATIC NAME: 1-(3-phenoxy-3-phenyl-propyl)pyrrolidine
MOLECULAR FORMULA: C19H23NO
MOLECULAR WEIGHT: 281.39202
SMILES: C1CCN(C1)CCC(C2=CC=CC=C2)OC3=CC=CC=C3
Structure:
CAS RN: 42780-43-8
CAS Name: 2-[1-(4-chlorophenyl)-2,5-dimethyl-3-pyrrolyl]propanoic acid
OPENEYE Name: 2-[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]propanoic acid
IUPAC Name: 2-[1-(4-chlorophenyl)-2,5-dimethylpyrrol-3-yl]propanoic acid
SYSTEMATIC NAME: 2-[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]propanoic acid
MOLECULAR FORMULA: C15H16ClNO2
MOLECULAR WEIGHT: 277.74604
SMILES: CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)C(C)C(=O)O
Structure:
CAS RN: 42780-42-7
CAS Name: 2-[1,2-dimethyl-5-(4-methylphenyl)-3-pyrrolyl]acetic acid
OPENEYE Name: 2-[1,2-dimethyl-5-(p-tolyl)pyrrol-3-yl]acetic acid
IUPAC Name: 2-[1,2-dimethyl-5-(4-methylphenyl)pyrrol-3-yl]acetic acid
SYSTEMATIC NAME: 2-[1,2-dimethyl-5-(4-methylphenyl)pyrrol-3-yl]ethanoic acid
MOLECULAR FORMULA: C15H17NO2
MOLECULAR WEIGHT: 243.30098
SMILES: CC1=CC=C(C=C1)C2=CC(=C(N2C)C)CC(=O)O
Structure:
CAS RN: 42780-41-6
CAS Name: 2-(1,2-dimethyl-5-phenyl-3-pyrrolyl)acetic acid
OPENEYE Name: 2-(1,2-dimethyl-5-phenyl-pyrrol-3-yl)acetic acid
IUPAC Name: 2-(1,2-dimethyl-5-phenylpyrrol-3-yl)acetic acid
SYSTEMATIC NAME: 2-(1,2-dimethyl-5-phenyl-pyrrol-3-yl)ethanoic acid
MOLECULAR FORMULA: C14H15NO2
MOLECULAR WEIGHT: 229.2744
SMILES: CC1=C(C=C(N1C)C2=CC=CC=C2)CC(=O)O
Structure:
CAS RN: 42780-40-5
CAS Name: 2-[1-(2,4-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]acetic acid
OPENEYE Name: 2-[1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]acetic acid
IUPAC Name: 2-[1-(2,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]acetic acid
SYSTEMATIC NAME: 2-[1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanoic acid
MOLECULAR FORMULA: C16H19NO2
MOLECULAR WEIGHT: 257.32756
SMILES: CC1=CC(=C(C=C1)N2C(=CC(=C2C)CC(=O)O)C)C
Structure:
CAS RN: 42780-39-2
CAS Name: 2-[2,5-dimethyl-1-(2,4,6-trimethylphenyl)-3-pyrrolyl]acetic acid
OPENEYE Name: 2-[2,5-dimethyl-1-(2,4,6-trimethylphenyl)pyrrol-3-yl]acetic acid
IUPAC Name: 2-[2,5-dimethyl-1-(2,4,6-trimethylphenyl)pyrrol-3-yl]acetic acid
SYSTEMATIC NAME: 2-[2,5-dimethyl-1-(2,4,6-trimethylphenyl)pyrrol-3-yl]ethanoic acid
MOLECULAR FORMULA: C17H21NO2
MOLECULAR WEIGHT: 271.35414
SMILES: CC1=CC(=C(C(=C1)C)N2C(=CC(=C2C)CC(=O)O)C)C
Structure:
CAS RN: 42780-38-1
CAS Name: 2-[1-(2,6-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]acetic acid
OPENEYE Name: 2-[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]acetic acid
IUPAC Name: 2-[1-(2,6-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]acetic acid
SYSTEMATIC NAME: 2-[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanoic acid
MOLECULAR FORMULA: C16H19NO2
MOLECULAR WEIGHT: 257.32756
SMILES: CC1=C(C(=CC=C1)C)N2C(=CC(=C2C)CC(=O)O)C
Structure:
CAS RN: 42780-35-8
CAS Name: 2-[1-(2,4-dichlorophenyl)-2,5-dimethyl-3-pyrrolyl]acetic acid
OPENEYE Name: 2-[1-(2,4-dichlorophenyl)-2,5-dimethyl-pyrrol-3-yl]acetic acid
IUPAC Name: 2-[1-(2,4-dichlorophenyl)-2,5-dimethylpyrrol-3-yl]acetic acid
SYSTEMATIC NAME: 2-[1-(2,4-dichlorophenyl)-2,5-dimethyl-pyrrol-3-yl]ethanoic acid
MOLECULAR FORMULA: C14H13Cl2NO2
MOLECULAR WEIGHT: 298.16452
SMILES: CC1=CC(=C(N1C2=C(C=C(C=C2)Cl)Cl)C)CC(=O)O
Structure:
CAS RN: 42780-31-4
CAS Name: 2-[1-(2,3-dichlorophenyl)-2,5-dimethyl-3-pyrrolyl]acetic acid
OPENEYE Name: 2-[1-(2,3-dichlorophenyl)-2,5-dimethyl-pyrrol-3-yl]acetic acid
IUPAC Name: 2-[1-(2,3-dichlorophenyl)-2,5-dimethylpyrrol-3-yl]acetic acid
SYSTEMATIC NAME: 2-[1-[2,3-bis(chloranyl)phenyl]-2,5-dimethyl-pyrrol-3-yl]ethanoic acid
MOLECULAR FORMULA: C14H13Cl2NO2
MOLECULAR WEIGHT: 298.16452
SMILES: CC1=CC(=C(N1C2=C(C(=CC=C2)Cl)Cl)C)CC(=O)O
Structure:
CAS RN: 42780-30-3
CAS Name: 2-[1-(2,5-dichlorophenyl)-2,5-dimethyl-3-pyrrolyl]acetic acid
OPENEYE Name: 2-[1-(2,5-dichlorophenyl)-2,5-dimethyl-pyrrol-3-yl]acetic acid
IUPAC Name: 2-[1-(2,5-dichlorophenyl)-2,5-dimethylpyrrol-3-yl]acetic acid
SYSTEMATIC NAME: 2-[1-[2,5-bis(chloranyl)phenyl]-2,5-dimethyl-pyrrol-3-yl]ethanoic acid
MOLECULAR FORMULA: C14H13Cl2NO2
MOLECULAR WEIGHT: 298.16452
SMILES: CC1=CC(=C(N1C2=C(C=CC(=C2)Cl)Cl)C)CC(=O)O
Structure:
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