CAS RN: 66710-74-5
CAS Name: N,N-bis(2-chloroethyl)-4-(4-nitrophenyl)azoaniline
OPENEYE Name: N,N-bis(2-chloroethyl)-4-(4-nitrophenyl)azo-aniline
IUPAC Name: N,N-bis(2-chloroethyl)-4-[(4-nitrophenyl)diazenyl]aniline
SYSTEMATIC NAME: N,N-bis(2-chloroethyl)-4-[(4-nitrophenyl)diazenyl]aniline
MOLECULAR FORMULA: C16H16Cl2N4O2
MOLECULAR WEIGHT: 367.22984
SMILES: C1=CC(=CC=C1N=NC2=CC=C(C=C2)[N+](=O)[O-])N(CCCl)CCCl
Structure:
CAS RN: 32099-84-6
CAS Name: 1-[4-[bis(3-chloro-2-hydroxypropyl)amino]-N-(3-chloro-2-hydroxypropyl)anilino]-3-chloro-2-propanol
OPENEYE Name: 1-[4-[bis(3-chloro-2-hydroxy-propyl)amino]-N-(3-chloro-2-hydroxy-propyl)anilino]-3-chloro-propan-2-ol
IUPAC Name: 1-[4-[bis(3-chloro-2-hydroxypropyl)amino]-N-(3-chloro-2-hydroxypropyl)anilino]-3-chloropropan-2-ol
SYSTEMATIC NAME: 1-[[4-[bis(3-chloranyl-2-oxidanyl-propyl)amino]phenyl]-(3-chloranyl-2-oxidanyl-propyl)amino]-3-chloranyl-propan-2-ol
MOLECULAR FORMULA: C18H28Cl4N2O4
MOLECULAR WEIGHT: 478.23792
SMILES: C1=CC(=CC=C1N(CC(CCl)O)CC(CCl)O)N(CC(CCl)O)CC(CCl)O
Structure:
CAS RN: 64977-16-8
CAS Name: N,N-bis(2-bromoethyl)-4-phenylaniline
OPENEYE Name: N,N-bis(2-bromoethyl)-4-phenyl-aniline
IUPAC Name: N,N-bis(2-bromoethyl)-4-phenylaniline
SYSTEMATIC NAME: N,N-bis(2-bromoethyl)-4-phenyl-aniline
MOLECULAR FORMULA: C16H17Br2N
MOLECULAR WEIGHT: 383.12088
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)N(CCBr)CCBr
Structure:
CAS RN: 4643-49-6
CAS Name: 1-chloro-3-(N-(3-chloro-2-hydroxypropyl)-4-methoxyanilino)-2-propanol
OPENEYE Name: 1-chloro-3-(N-(3-chloro-2-hydroxy-propyl)-4-methoxy-anilino)propan-2-ol
IUPAC Name: 1-chloro-3-(N-(3-chloro-2-hydroxypropyl)-4-methoxyanilino)propan-2-ol
SYSTEMATIC NAME: 1-chloranyl-3-[(3-chloranyl-2-oxidanyl-propyl)-(4-methoxyphenyl)amino]propan-2-ol
MOLECULAR FORMULA: C13H19Cl2NO3
MOLECULAR WEIGHT: 308.20086
SMILES: COC1=CC=C(C=C1)N(CC(CCl)O)CC(CCl)O
Structure:
CAS RN: 64977-12-4
CAS Name: N,N-bis(2-bromoethyl)-4-chloroaniline
OPENEYE Name: N,N-bis(2-bromoethyl)-4-chloro-aniline
IUPAC Name: N,N-bis(2-bromoethyl)-4-chloroaniline
SYSTEMATIC NAME: N,N-bis(2-bromoethyl)-4-chloranyl-aniline
MOLECULAR FORMULA: C10H12Br2ClN
MOLECULAR WEIGHT: 341.46998
SMILES: C1=CC(=CC=C1N(CCBr)CCBr)Cl
Structure:
CAS RN: 56403-10-2
CAS Name: 2-methyl-3-(4-nitrophenyl)-2-oxiranecarbothioic acid S-tert-butyl ester
OPENEYE Name: S-tert-butyl 2-methyl-3-(4-nitrophenyl)oxirane-2-carbothioate
IUPAC Name: S-tert-butyl 2-methyl-3-(4-nitrophenyl)oxirane-2-carbothioate
SYSTEMATIC NAME: S-tert-butyl 2-methyl-3-(4-nitrophenyl)oxirane-2-carbothioate
MOLECULAR FORMULA: C14H17NO4S
MOLECULAR WEIGHT: 295.35408
SMILES: CC1(C(O1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)SC(C)(C)C
Structure:
CAS RN: 60276-60-0
CAS Name: 1-bromo-4,4-dichloro-2-(3,5-dimethylphenyl)-2-pentanol
OPENEYE Name: 1-bromo-4,4-dichloro-2-(3,5-dimethylphenyl)pentan-2-ol
IUPAC Name: 1-bromo-4,4-dichloro-2-(3,5-dimethylphenyl)pentan-2-ol
SYSTEMATIC NAME: 1-bromanyl-4,4-bis(chloranyl)-2-(3,5-dimethylphenyl)pentan-2-ol
MOLECULAR FORMULA: C13H17BrCl2O
MOLECULAR WEIGHT: 340.08348
SMILES: CC1=CC(=CC(=C1)C(CC(C)(Cl)Cl)(CBr)O)C
Structure:
CAS RN: 65441-78-3
CAS Name: 4-chlorobenzoic acid (3,5,5-trimethyl-4H-pyrazol-3-yl) ester
OPENEYE Name: (3,5,5-trimethyl-4H-pyrazol-3-yl) 4-chlorobenzoate
IUPAC Name: (3,5,5-trimethyl-4H-pyrazol-3-yl) 4-chlorobenzoate
SYSTEMATIC NAME: (3,5,5-trimethyl-4H-pyrazol-3-yl) 4-chloranylbenzoate
MOLECULAR FORMULA: C13H15ClN2O2
MOLECULAR WEIGHT: 266.7234
SMILES: CC1(CC(N=N1)(C)OC(=O)C2=CC=C(C=C2)Cl)C
Structure:
CAS RN: 17660-55-8
CAS Name: 2,3-bis(acetylthio)butanedioic acid
OPENEYE Name: 2,3-bis(acetylsulfanyl)butanedioic acid
IUPAC Name: 2,3-bis(acetylsulfanyl)butanedioic acid
SYSTEMATIC NAME: 2,3-bis(ethanoylsulfanyl)butanedioic acid
MOLECULAR FORMULA: C8H10O6S2
MOLECULAR WEIGHT: 266.2914
SMILES: CC(=O)SC(C(C(=O)O)SC(=O)C)C(=O)O
Structure:
CAS RN: 92755-15-2
CAS Name: 6-chloro-3-phenyl-2-oxazolo[4,5-b]pyridinone
OPENEYE Name: 6-chloro-3-phenyl-oxazolo[4,5-b]pyridin-2-one
IUPAC Name: 6-chloro-3-phenyl-[1,3]oxazolo[4,5-b]pyridin-2-one
SYSTEMATIC NAME: 6-chloranyl-3-phenyl-[1,3]oxazolo[4,5-b]pyridin-2-one
MOLECULAR FORMULA: C12H7ClN2O2
MOLECULAR WEIGHT: 246.64918
SMILES: C1=CC=C(C=C1)N2C3=NC=C(C=C3OC2=O)Cl
Structure:
CAS RN: 14316-61-1
CAS Name: 2-phenoxyacetic acid (1-oxo-2-phenoxyethyl) ester
OPENEYE Name: (2-phenoxyacetyl) 2-phenoxyacetate
IUPAC Name: (2-phenoxyacetyl) 2-phenoxyacetate
SYSTEMATIC NAME: 2-phenoxyethanoyl 2-phenoxyethanoate
MOLECULAR FORMULA: C16H14O5
MOLECULAR WEIGHT: 286.27936
SMILES: C1=CC=C(C=C1)OCC(=O)OC(=O)COC2=CC=CC=C2
Structure:
CAS RN: 34359-78-9
CAS Name: 2-(4-chlorophenoxy)acetic acid [2-(4-chlorophenoxy)-1-oxoethyl] ester
OPENEYE Name: [2-(4-chlorophenoxy)acetyl] 2-(4-chlorophenoxy)acetate
IUPAC Name: [2-(4-chlorophenoxy)acetyl] 2-(4-chlorophenoxy)acetate
SYSTEMATIC NAME: 2-(4-chloranylphenoxy)ethanoyl 2-(4-chloranylphenoxy)ethanoate
MOLECULAR FORMULA: C16H12Cl2O5
MOLECULAR WEIGHT: 355.16948
SMILES: C1=CC(=CC=C1OCC(=O)OC(=O)COC2=CC=C(C=C2)Cl)Cl
Structure:
CAS RN: 61196-75-6
CAS Name: 1-(4-nitrophenyl)-3-pyridin-4-yl-2-propen-1-one
OPENEYE Name: 1-(4-nitrophenyl)-3-(4-pyridyl)prop-2-en-1-one
IUPAC Name: 1-(4-nitrophenyl)-3-pyridin-4-ylprop-2-en-1-one
SYSTEMATIC NAME: 1-(4-nitrophenyl)-3-pyridin-4-yl-prop-2-en-1-one
MOLECULAR FORMULA: C14H10N2O3
MOLECULAR WEIGHT: 254.2408
SMILES: C1=CC(=CC=C1C(=O)C=CC2=CC=NC=C2)[N+](=O)[O-]
Structure:
CAS RN: 58058-58-5
CAS Name: 1-[hydroxy(phenyl)methyl]-1-cyclopropanecarbothioic acid S-tert-butyl ester
OPENEYE Name: S-tert-butyl 1-[hydroxy(phenyl)methyl]cyclopropanecarbothioate
IUPAC Name: S-tert-butyl 1-[hydroxy(phenyl)methyl]cyclopropane-1-carbothioate
SYSTEMATIC NAME: S-tert-butyl 1-[oxidanyl(phenyl)methyl]cyclopropane-1-carbothioate
MOLECULAR FORMULA: C15H20O2S
MOLECULAR WEIGHT: 264.3831
SMILES: CC(C)(C)SC(=O)C1(CC1)C(C2=CC=CC=C2)O
Structure:
CAS RN: 58058-60-9
CAS Name: 3-hydroxy-3,3-diphenylpropanethioic acid S-(phenylmethyl) ester
OPENEYE Name: S-benzyl 3-hydroxy-3,3-diphenyl-propanethioate
IUPAC Name: S-benzyl 3-hydroxy-3,3-diphenylpropanethioate
SYSTEMATIC NAME: S-(phenylmethyl) 3-oxidanyl-3,3-diphenyl-propanethioate
MOLECULAR FORMULA: C22H20O2S
MOLECULAR WEIGHT: 348.458
SMILES: C1=CC=C(C=C1)CSC(=O)CC(C2=CC=CC=C2)(C3=CC=CC=C3)O
Structure:
CAS RN: 58058-61-0
CAS Name: 3-hydroxy-3,3-diphenylpropanethioic acid S-phenyl ester
OPENEYE Name: S-phenyl 3-hydroxy-3,3-diphenyl-propanethioate
IUPAC Name: S-phenyl 3-hydroxy-3,3-diphenylpropanethioate
SYSTEMATIC NAME: S-phenyl 3-oxidanyl-3,3-diphenyl-propanethioate
MOLECULAR FORMULA: C21H18O2S
MOLECULAR WEIGHT: 334.43142
SMILES: C1=CC=C(C=C1)C(CC(=O)SC2=CC=CC=C2)(C3=CC=CC=C3)O
Structure:
CAS RN: 58058-57-4
CAS Name: 3-hydroxy-3,3-diphenylpropanethioic acid S-tert-butyl ester
OPENEYE Name: S-tert-butyl 3-hydroxy-3,3-diphenyl-propanethioate
IUPAC Name: S-tert-butyl 3-hydroxy-3,3-diphenylpropanethioate
SYSTEMATIC NAME: S-tert-butyl 3-oxidanyl-3,3-diphenyl-propanethioate
MOLECULAR FORMULA: C19H22O2S
MOLECULAR WEIGHT: 314.44178
SMILES: CC(C)(C)SC(=O)CC(C1=CC=CC=C1)(C2=CC=CC=C2)O
Structure:
CAS RN: 42479-96-9
CAS Name: 3-hydroxy-3-phenylpropanethioic acid S-phenyl ester
OPENEYE Name: S-phenyl 3-hydroxy-3-phenyl-propanethioate
IUPAC Name: S-phenyl 3-hydroxy-3-phenylpropanethioate
SYSTEMATIC NAME: S-phenyl 3-oxidanyl-3-phenyl-propanethioate
MOLECULAR FORMULA: C15H14O2S
MOLECULAR WEIGHT: 258.33546
SMILES: C1=CC=C(C=C1)C(CC(=O)SC2=CC=CC=C2)O
Structure:
CAS RN: 61540-14-5
CAS Name: 4-pentenethioic acid S-tert-butyl ester
OPENEYE Name: S-tert-butyl pent-4-enethioate
IUPAC Name: S-tert-butyl pent-4-enethioate
SYSTEMATIC NAME: S-tert-butyl pent-4-enethioate
MOLECULAR FORMULA: C9H16OS
MOLECULAR WEIGHT: 172.28774
SMILES: CC(C)(C)SC(=O)CCC=C
Structure:
CAS RN: 56377-56-1
CAS Name: 2-(tert-butylthio)propanethioic acid S-tert-butyl ester
OPENEYE Name: S-tert-butyl 2-tert-butylsulfanylpropanethioate
IUPAC Name: S-tert-butyl 2-tert-butylsulfanylpropanethioate
SYSTEMATIC NAME: S-tert-butyl 2-tert-butylsulfanylpropanethioate
MOLECULAR FORMULA: C11H22OS2
MOLECULAR WEIGHT: 234.42178
SMILES: CC(C(=O)SC(C)(C)C)SC(C)(C)C
Structure:
CAS RN: 56403-12-4
CAS Name: 2-bromobutanethioic acid S-tert-butyl ester
OPENEYE Name: S-tert-butyl 2-bromobutanethioate
IUPAC Name: S-tert-butyl 2-bromobutanethioate
SYSTEMATIC NAME: S-tert-butyl 2-bromanylbutanethioate
MOLECULAR FORMULA: C8H15BrOS
MOLECULAR WEIGHT: 239.1731
SMILES: CCC(C(=O)SC(C)(C)C)Br
Structure:
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