CAS RN: 42149-74-6
CAS Name: 1-(2-chloroethoxy)propane
OPENEYE Name: 1-(2-chloroethoxy)propane
IUPAC Name: 1-(2-chloroethoxy)propane
SYSTEMATIC NAME: 1-(2-chloroethyloxy)propane
MOLECULAR FORMULA: C5H11ClO
MOLECULAR WEIGHT: 122.59324
SMILES: CCCOCCCl
Structure:
CAS RN: 42019-78-3
CAS Name: (4-chlorophenyl)-(4-hydroxyphenyl)methanone
OPENEYE Name: (4-chlorophenyl)-(4-hydroxyphenyl)methanone
IUPAC Name: (4-chlorophenyl)-(4-hydroxyphenyl)methanone
SYSTEMATIC NAME: (4-chlorophenyl)-(4-hydroxyphenyl)methanone
MOLECULAR FORMULA: C13H9ClO2
MOLECULAR WEIGHT: 232.66236
SMILES: C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)Cl)O
Structure:
CAS RN: 4396-71-8
CAS Name: 1,4,8,11-tetramethyl-1,4,8,11-tetrazacyclotetradecane
OPENEYE Name: 1,4,8,11-tetramethyl-1,4,8,11-tetrazacyclotetradecane
IUPAC Name: 1,4,8,11-tetramethyl-1,4,8,11-tetrazacyclotetradecane
SYSTEMATIC NAME: 1,4,8,11-tetramethyl-1,4,8,11-tetrazacyclotetradecane
MOLECULAR FORMULA: C14H32N4
MOLECULAR WEIGHT: 256.43068
SMILES: CN1CCCN(CCN(CCCN(CC1)C)C)C
Structure:
CAS RN: 41051-15-4
CAS Name: 4-methoxy-3-oxobutanoic acid methyl ester
OPENEYE Name: methyl 4-methoxy-3-oxo-butanoate
IUPAC Name: methyl 4-methoxy-3-oxobutanoate
SYSTEMATIC NAME: methyl 4-methoxy-3-oxidanylidene-butanoate
MOLECULAR FORMULA: C6H10O4
MOLECULAR WEIGHT: 146.1412
SMILES: COCC(=O)CC(=O)OC
Structure:
CAS RN: 40889-91-6
CAS Name: 2-chloro-5-(trifluoromethyl)phenol
OPENEYE Name: 2-chloro-5-(trifluoromethyl)phenol
IUPAC Name: 2-chloro-5-(trifluoromethyl)phenol
SYSTEMATIC NAME: 2-chloranyl-5-(trifluoromethyl)phenol
MOLECULAR FORMULA: C7H4ClF3O
MOLECULAR WEIGHT: 196.55427
SMILES: C1=CC(=C(C=C1C(F)(F)F)O)Cl
Structure:
CAS RN: 4342-49-8
CAS Name: (4-methyl-3-nitrophenyl)methanol
OPENEYE Name: (4-methyl-3-nitro-phenyl)methanol
IUPAC Name: (4-methyl-3-nitrophenyl)methanol
SYSTEMATIC NAME: (4-methyl-3-nitro-phenyl)methanol
MOLECULAR FORMULA: C8H9NO3
MOLECULAR WEIGHT: 167.16196
SMILES: CC1=C(C=C(C=C1)CO)[N+](=O)[O-]
Structure:
CAS RN: 4271-19-6
CAS Name: nitric acid bromo ester
OPENEYE Name: bromo nitrate
IUPAC Name: bromo nitrate
SYSTEMATIC NAME: bromanyl nitrate
MOLECULAR FORMULA: BrNO3
MOLECULAR WEIGHT: 141.9089
SMILES: [N+](=O)([O-])OBr
Structure:
CAS RN: 39998-81-7
CAS Name: 2-fluoro-4-iodo-1-methylbenzene
OPENEYE Name: 2-fluoro-4-iodo-1-methyl-benzene
IUPAC Name: 2-fluoro-4-iodo-1-methylbenzene
SYSTEMATIC NAME: 2-fluoranyl-4-iodanyl-1-methyl-benzene
MOLECULAR FORMULA: C7H6FI
MOLECULAR WEIGHT: 236.025413
SMILES: CC1=C(C=C(C=C1)I)F
Structure:
CAS RN: 39905-45-8
CAS Name: 4-octoxyaniline
OPENEYE Name: 4-octoxyaniline
IUPAC Name: 4-octoxyaniline
SYSTEMATIC NAME: 4-octoxyaniline
MOLECULAR FORMULA: C14H23NO
MOLECULAR WEIGHT: 221.33852
SMILES: CCCCCCCCOC1=CC=C(C=C1)N
Structure:
CAS RN: 39811-17-1
CAS Name: 2-methoxy-5-phenylaniline
OPENEYE Name: 2-methoxy-5-phenyl-aniline
IUPAC Name: 2-methoxy-5-phenylaniline
SYSTEMATIC NAME: 2-methoxy-5-phenyl-aniline
MOLECULAR FORMULA: C13H13NO
MOLECULAR WEIGHT: 199.24842
SMILES: COC1=C(C=C(C=C1)C2=CC=CC=C2)N
Structure:
CAS RN: 39777-05-4
CAS Name: 1-(4-butoxyphenyl)-N-(4-pentylphenyl)methanimine
OPENEYE Name: 1-(4-butoxyphenyl)-N-(4-pentylphenyl)methanimine
IUPAC Name: 1-(4-butoxyphenyl)-N-(4-pentylphenyl)methanimine
SYSTEMATIC NAME: 1-(4-butoxyphenyl)-N-(4-pentylphenyl)methanimine
MOLECULAR FORMULA: C22H29NO
MOLECULAR WEIGHT: 323.47176
SMILES: CCCCCC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OCCCC
Structure:
CAS RN: 39652-32-9
CAS Name: (3-chloro-4-methylphenyl)methanol
OPENEYE Name: (3-chloro-4-methyl-phenyl)methanol
IUPAC Name: (3-chloro-4-methylphenyl)methanol
SYSTEMATIC NAME: (3-chloranyl-4-methyl-phenyl)methanol
MOLECULAR FORMULA: C8H9ClO
MOLECULAR WEIGHT: 156.60946
SMILES: CC1=C(C=C(C=C1)CO)Cl
Structure:
CAS RN: 41499-78-9
CAS Name: (3-chloro-4-methylphenyl)methanol
OPENEYE Name: (3-chloro-4-methyl-phenyl)methanol
IUPAC Name: (3-chloro-4-methylphenyl)methanol
SYSTEMATIC NAME: (3-chloranyl-4-methyl-phenyl)methanol
MOLECULAR FORMULA: C8H9ClO
MOLECULAR WEIGHT: 156.60946
SMILES: CC1=C(C=C(C=C1)CO)Cl
Structure:
CAS RN: 39627-84-4
CAS Name: 2-naphthalenecarbohydrazide
OPENEYE Name: naphthalene-2-carbohydrazide
IUPAC Name: naphthalene-2-carbohydrazide
SYSTEMATIC NAME: naphthalene-2-carbohydrazide
MOLECULAR FORMULA: C11H10N2O
MOLECULAR WEIGHT: 186.2099
SMILES: C1=CC=C2C=C(C=CC2=C1)C(=O)NN
Structure:
CAS RN: 39536-61-3
CAS Name: N-butyl-1-pentanamine
OPENEYE Name: N-butylpentan-1-amine
IUPAC Name: N-butylpentan-1-amine
SYSTEMATIC NAME: N-butylpentan-1-amine
MOLECULAR FORMULA: C9H21N
MOLECULAR WEIGHT: 143.26974
SMILES: CCCCCNCCCC
Structure:
CAS RN: 39135-39-2
CAS Name: 2,6-dimethyl-1-piperidinamine
OPENEYE Name: 2,6-dimethylpiperidin-1-amine
IUPAC Name: 2,6-dimethylpiperidin-1-amine
SYSTEMATIC NAME: 2,6-dimethylpiperidin-1-amine
MOLECULAR FORMULA: C7H16N2
MOLECULAR WEIGHT: 128.21534
SMILES: CC1CCCC(N1N)C
Structure:
CAS RN: 4097-82-9
CAS Name: 2-(3,5-dimethylphenyl)acetonitrile
OPENEYE Name: 2-(3,5-dimethylphenyl)acetonitrile
IUPAC Name: 2-(3,5-dimethylphenyl)acetonitrile
SYSTEMATIC NAME: 2-(3,5-dimethylphenyl)ethanenitrile
MOLECULAR FORMULA: C10H11N
MOLECULAR WEIGHT: 145.20104
SMILES: CC1=CC(=CC(=C1)CC#N)C
Structure:
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