CAS RN: 45077-13-2
CAS Name: acetic acid (6-amino-2-methylheptan-2-yl) ester
OPENEYE Name: (5-amino-1,1-dimethyl-hexyl) acetate
IUPAC Name: (6-amino-2-methylheptan-2-yl) acetate
SYSTEMATIC NAME: (6-azanyl-2-methyl-heptan-2-yl) ethanoate
MOLECULAR FORMULA: C10H21NO2
MOLECULAR WEIGHT: 187.27924
SMILES: CC(CCCC(C)(C)OC(=O)C)N
Structure:
CAS RN: 45037-67-0
CAS Name: decanedial
OPENEYE Name: decanedial
IUPAC Name: decanedial
SYSTEMATIC NAME: decanedial
MOLECULAR FORMULA: C10H18O2
MOLECULAR WEIGHT: 170.24872
SMILES: C(CCCCC=O)CCCC=O
Structure:
CAS RN: 45023-48-1
CAS Name: 2-methyl-2-propenoic acid 2-propoxyethyl ester
OPENEYE Name: 2-propoxyethyl 2-methylprop-2-enoate
IUPAC Name: 2-propoxyethyl 2-methylprop-2-enoate
SYSTEMATIC NAME: 2-propoxyethyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C9H16O3
MOLECULAR WEIGHT: 172.22154
SMILES: CCCOCCOC(=O)C(=C)C
Structure:
CAS RN: 45019-22-5
CAS Name: 2-propenoic acid 2-methylhexyl ester
OPENEYE Name: 2-methylhexyl prop-2-enoate
IUPAC Name: 2-methylhexyl prop-2-enoate
SYSTEMATIC NAME: 2-methylhexyl prop-2-enoate
MOLECULAR FORMULA: C10H18O2
MOLECULAR WEIGHT: 170.24872
SMILES: CCCCC(C)COC(=O)C=C
Structure:
CAS RN: 44898-13-7
CAS Name: 2-cyano-2-propenoic acid prop-2-ynyl ester
OPENEYE Name: prop-2-ynyl 2-cyanoprop-2-enoate
IUPAC Name: prop-2-ynyl 2-cyanoprop-2-enoate
SYSTEMATIC NAME: prop-2-ynyl 2-cyanoprop-2-enoate
MOLECULAR FORMULA: C7H5NO2
MOLECULAR WEIGHT: 135.1201
SMILES: C=C(C#N)C(=O)OCC#C
Structure:
CAS RN: 44816-77-5
CAS Name: N2-(2-aminopropyl)propane-1,2-diamine
OPENEYE Name: N2-(2-aminopropyl)propane-1,2-diamine
IUPAC Name: 2-N-(2-aminopropyl)propane-1,2-diamine
SYSTEMATIC NAME: N2-(2-azanylpropyl)propane-1,2-diamine
MOLECULAR FORMULA: C6H17N3
MOLECULAR WEIGHT: 131.21928
SMILES: CC(CN)NCC(C)N
Structure:
CAS RN: 44641-39-6
CAS Name: 2,4-dichloro-3-hydroxybutanal
OPENEYE Name: 2,4-dichloro-3-hydroxy-butanal
IUPAC Name: 2,4-dichloro-3-hydroxybutanal
SYSTEMATIC NAME: 2,4-bis(chloranyl)-3-oxidanyl-butanal
MOLECULAR FORMULA: C4H6Cl2O2
MOLECULAR WEIGHT: 156.99524
SMILES: C(C(C(C=O)Cl)O)Cl
Structure:
CAS RN: 44513-97-5
CAS Name: dichloromolybdenum; nitroxyl anion
OPENEYE Name: dichloromolybdenum; nitroxyl anion
IUPAC Name: dichloromolybdenum; nitroxyl anion
SYSTEMATIC NAME: bis(chloranyl)molybdenum; oxoazanide
MOLECULAR FORMULA: Cl2MoN2O2-2
MOLECULAR WEIGHT: 226.8582
SMILES: [N-]=O.[N-]=O.Cl[Mo]Cl
Structure:
CAS RN: 44307-07-5
CAS Name: ethane-1,1,2,2-tetrol
OPENEYE Name: ethane-1,1,2,2-tetrol
IUPAC Name: ethane-1,1,2,2-tetrol
SYSTEMATIC NAME: ethane-1,1,2,2-tetrol
MOLECULAR FORMULA: C2H6O4
MOLECULAR WEIGHT: 94.06664
SMILES: C(C(O)O)(O)O
Structure:
CAS RN: 43230-06-4
CAS Name: (4-nitrosophenyl)hydrazine
OPENEYE Name: (4-nitrosophenyl)hydrazine
IUPAC Name: (4-nitrosophenyl)hydrazine
SYSTEMATIC NAME: (4-nitrosophenyl)diazane
MOLECULAR FORMULA: C6H7N3O
MOLECULAR WEIGHT: 137.13928
SMILES: C1=CC(=CC=C1NN)N=O
Structure:
CAS RN: 43229-65-8
CAS Name: 1-(4-methoxyphenyl)-N-(phenylmethyl)-2-propanamine
OPENEYE Name: N-benzyl-1-(4-methoxyphenyl)propan-2-amine
IUPAC Name: N-benzyl-1-(4-methoxyphenyl)propan-2-amine
SYSTEMATIC NAME: 1-(4-methoxyphenyl)-N-(phenylmethyl)propan-2-amine
MOLECULAR FORMULA: C17H21NO
MOLECULAR WEIGHT: 255.35474
SMILES: CC(CC1=CC=C(C=C1)OC)NCC2=CC=CC=C2
Structure:
CAS RN: 43218-35-5
CAS Name: 3-benzamido-2-methylpropanoic acid
OPENEYE Name: 3-benzamido-2-methyl-propanoic acid
IUPAC Name: 3-benzamido-2-methylpropanoic acid
SYSTEMATIC NAME: 3-benzamido-2-methyl-propanoic acid
MOLECULAR FORMULA: C11H13NO3
MOLECULAR WEIGHT: 207.22582
SMILES: CC(CNC(=O)C1=CC=CC=C1)C(=O)O
Structure:
CAS RN: 43193-60-8
CAS Name: pyrazine-2,3,5,6-tetracarboxylic acid
OPENEYE Name: pyrazine-2,3,5,6-tetracarboxylic acid
IUPAC Name: pyrazine-2,3,5,6-tetracarboxylic acid
SYSTEMATIC NAME: pyrazine-2,3,5,6-tetracarboxylic acid
MOLECULAR FORMULA: C8H4N2O8
MOLECULAR WEIGHT: 256.12596
SMILES: C1(=C(N=C(C(=N1)C(=O)O)C(=O)O)C(=O)O)C(=O)O
Structure:
CAS RN: 43192-32-1
CAS Name: 2-bromo-5-ethoxybenzaldehyde
OPENEYE Name: 2-bromo-5-ethoxy-benzaldehyde
IUPAC Name: 2-bromo-5-ethoxybenzaldehyde
SYSTEMATIC NAME: 2-bromanyl-5-ethoxy-benzaldehyde
MOLECULAR FORMULA: C9H9BrO2
MOLECULAR WEIGHT: 229.07056
SMILES: CCOC1=CC(=C(C=C1)Br)C=O
Structure:
CAS RN: 43192-10-5
CAS Name: N-(2,4-dichlorophenyl)hydroxylamine
OPENEYE Name: N-(2,4-dichlorophenyl)hydroxylamine
IUPAC Name: N-(2,4-dichlorophenyl)hydroxylamine
SYSTEMATIC NAME: N-(2,4-dichlorophenyl)hydroxylamine
MOLECULAR FORMULA: C6H5Cl2NO
MOLECULAR WEIGHT: 178.016
SMILES: C1=CC(=C(C=C1Cl)Cl)NO
Structure:
CAS RN: 43156-48-5
CAS Name: 4-(phenylthio)benzene-1,2-diamine
OPENEYE Name: 4-phenylsulfanylbenzene-1,2-diamine
IUPAC Name: 4-phenylsulfanylbenzene-1,2-diamine
SYSTEMATIC NAME: 4-phenylsulfanylbenzene-1,2-diamine
MOLECULAR FORMULA: C12H12N2S
MOLECULAR WEIGHT: 216.30208
SMILES: C1=CC=C(C=C1)SC2=CC(=C(C=C2)N)N
Structure:
CAS RN: 43152-58-5
CAS Name: 4-hydroxy-5-undecyl-1,3-benzothiazole-6,7-dione
OPENEYE Name: 4-hydroxy-5-undecyl-1,3-benzothiazole-6,7-dione
IUPAC Name: 4-hydroxy-5-undecyl-1,3-benzothiazole-6,7-dione
SYSTEMATIC NAME: 4-oxidanyl-5-undecyl-1,3-benzothiazole-6,7-dione
MOLECULAR FORMULA: C18H25NO3S
MOLECULAR WEIGHT: 335.461
SMILES: CCCCCCCCCCCC1=C(C2=C(C(=O)C1=O)SC=N2)O
Structure:
CAS RN: 43119-53-5
CAS Name: 2,3-dihydrobenzofuran-2-carboxylic acid ethyl ester
OPENEYE Name: ethyl 2,3-dihydrobenzofuran-2-carboxylate
IUPAC Name: ethyl 2,3-dihydro-1-benzofuran-2-carboxylate
SYSTEMATIC NAME: ethyl 2,3-dihydro-1-benzofuran-2-carboxylate
MOLECULAR FORMULA: C11H12O3
MOLECULAR WEIGHT: 192.21118
SMILES: CCOC(=O)C1CC2=CC=CC=C2O1
Structure:
CAS RN: 43094-97-9
CAS Name: 1-(carboxymethyl)-5-oxo-3-pyrrolidinecarboxylic acid
OPENEYE Name: 1-(carboxymethyl)-5-oxo-pyrrolidine-3-carboxylic acid
IUPAC Name: 1-(carboxymethyl)-5-oxopyrrolidine-3-carboxylic acid
SYSTEMATIC NAME: 1-(2-hydroxy-2-oxoethyl)-5-oxidanylidene-pyrrolidine-3-carboxylic acid
MOLECULAR FORMULA: C7H9NO5
MOLECULAR WEIGHT: 187.15006
SMILES: C1C(CN(C1=O)CC(=O)O)C(=O)O
Structure:
CAS RN: 43094-86-6
CAS Name: 1-butyl-5-oxo-3-pyrrolidinecarboxylic acid
OPENEYE Name: 1-butyl-5-oxo-pyrrolidine-3-carboxylic acid
IUPAC Name: 1-butyl-5-oxopyrrolidine-3-carboxylic acid
SYSTEMATIC NAME: 1-butyl-5-oxidanylidene-pyrrolidine-3-carboxylic acid
MOLECULAR FORMULA: C9H15NO3
MOLECULAR WEIGHT: 185.2203
SMILES: CCCCN1CC(CC1=O)C(=O)O
Structure:
CAS RN: 4779-94-6
CAS Name: 3-(2-amino-1-hydroxyethyl)phenol hydrochloride
OPENEYE Name: 3-(2-amino-1-hydroxy-ethyl)phenol hydrochloride
IUPAC Name: 3-(2-amino-1-hydroxyethyl)phenol hydrochloride
SYSTEMATIC NAME: 3-(2-azanyl-1-oxidanyl-ethyl)phenol hydrochloride
MOLECULAR FORMULA: C8H12ClNO2
MOLECULAR WEIGHT: 189.63938
SMILES: C1=CC(=CC(=C1)O)C(CN)O.Cl
Structure:
CAS RN: 43064-52-4
CAS Name: 2-hydroxy-2-propan-2-ylbutanedioic acid dimethyl ester
OPENEYE Name: dimethyl 2-hydroxy-2-isopropyl-butanedioate
IUPAC Name: dimethyl 2-hydroxy-2-propan-2-ylbutanedioate
SYSTEMATIC NAME: dimethyl 2-oxidanyl-2-propan-2-yl-butanedioate
MOLECULAR FORMULA: C9H16O5
MOLECULAR WEIGHT: 204.22034
SMILES: CC(C)C(CC(=O)OC)(C(=O)OC)O
Structure:
CAS RN: 43056-63-9
CAS Name: 3-amino-5-(4-morpholinylmethyl)-2-oxazolidinone
OPENEYE Name: 3-amino-5-(morpholinomethyl)oxazolidin-2-one
IUPAC Name: 3-amino-5-(morpholin-4-ylmethyl)-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 3-azanyl-5-(morpholin-4-ylmethyl)-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C8H15N3O3
MOLECULAR WEIGHT: 201.223
SMILES: C1COCCN1CC2CN(C(=O)O2)N
Structure:
CAS RN: 43052-39-7
CAS Name: pentanedioic acid ditert-butyl ester
OPENEYE Name: ditert-butyl pentanedioate
IUPAC Name: ditert-butyl pentanedioate
SYSTEMATIC NAME: ditert-butyl pentanedioate
MOLECULAR FORMULA: C13H24O4
MOLECULAR WEIGHT: 244.32726
SMILES: CC(C)(C)OC(=O)CCCC(=O)OC(C)(C)C
Structure:
CAS RN: 43002-00-2
CAS Name: 2-bromo-6-methylsulfonyl-4-nitroaniline
OPENEYE Name: 2-bromo-6-methylsulfonyl-4-nitro-aniline
IUPAC Name: 2-bromo-6-methylsulfonyl-4-nitroaniline
SYSTEMATIC NAME: 2-bromanyl-6-methylsulfonyl-4-nitro-aniline
MOLECULAR FORMULA: C7H7BrN2O4S
MOLECULAR WEIGHT: 295.11048
SMILES: CS(=O)(=O)C1=C(C(=CC(=C1)[N+](=O)[O-])Br)N
Structure:
CAS RN: 42989-16-2
CAS Name: 2,4,5-trichloro-6-cyano-3-phenoxybenzoic acid methyl ester
OPENEYE Name: methyl 2,4,5-trichloro-6-cyano-3-phenoxy-benzoate
IUPAC Name: methyl 2,4,5-trichloro-6-cyano-3-phenoxybenzoate
SYSTEMATIC NAME: methyl 2,4,5-tris(chloranyl)-6-cyano-3-phenoxy-benzoate
MOLECULAR FORMULA: C15H8Cl3NO3
MOLECULAR WEIGHT: 356.58792
SMILES: COC(=O)C1=C(C(=C(C(=C1Cl)OC2=CC=CC=C2)Cl)Cl)C#N
Structure:
CAS RN: 42977-21-9
CAS Name: 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-10-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyldisulfanyl)decane
OPENEYE Name: 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-10-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyldisulfanyl)decane
IUPAC Name: 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-10-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyldisulfanyl)decane
SYSTEMATIC NAME: 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecakis(fluoranyl)-10-[3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecakis(fluoranyl)decyldisulfanyl]decane
MOLECULAR FORMULA: C20H8F34S2
MOLECULAR WEIGHT: 958.353229
SMILES: C(CSSCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Structure:
CAS RN: 42966-04-1
CAS Name: N'-[2-(2-undecyl-4,5-dihydroimidazol-1-yl)ethyl]ethane-1,2-diamine
OPENEYE Name: N'-[2-(2-undecyl-4,5-dihydroimidazol-1-yl)ethyl]ethane-1,2-diamine
IUPAC Name: N'-[2-(2-undecyl-4,5-dihydroimidazol-1-yl)ethyl]ethane-1,2-diamine
SYSTEMATIC NAME: N'-[2-(2-undecyl-4,5-dihydroimidazol-1-yl)ethyl]ethane-1,2-diamine
MOLECULAR FORMULA: C18H38N4
MOLECULAR WEIGHT: 310.52112
SMILES: CCCCCCCCCCCC1=NCCN1CCNCCN
Structure:
CAS RN: 42959-99-9
CAS Name: (2-bromo-3-nitrophenyl)-phenylmethanone
OPENEYE Name: (2-bromo-3-nitro-phenyl)-phenyl-methanone
IUPAC Name: (2-bromo-3-nitrophenyl)-phenylmethanone
SYSTEMATIC NAME: (2-bromanyl-3-nitro-phenyl)-phenyl-methanone
MOLECULAR FORMULA: C13H8BrNO3
MOLECULAR WEIGHT: 306.11152
SMILES: C1=CC=C(C=C1)C(=O)C2=C(C(=CC=C2)[N+](=O)[O-])Br
Structure:
CAS RN: 42926-52-3
CAS Name: 2-ethoxybenzoyl chloride
OPENEYE Name: 2-ethoxybenzoyl chloride
IUPAC Name: 2-ethoxybenzoyl chloride
SYSTEMATIC NAME: 2-ethoxybenzoyl chloride
MOLECULAR FORMULA: C9H9ClO2
MOLECULAR WEIGHT: 184.61956
SMILES: CCOC1=CC=CC=C1C(=O)Cl
Structure:
CAS RN: 42919-21-1
CAS Name: 2-azidobenzene-1,3-dicarboxylic acid
OPENEYE Name: 2-azidobenzene-1,3-dicarboxylic acid
IUPAC Name: 2-azidobenzene-1,3-dicarboxylic acid
SYSTEMATIC NAME: 2-azidobenzene-1,3-dicarboxylic acid
MOLECULAR FORMULA: C8H5N3O4
MOLECULAR WEIGHT: 207.143
SMILES: C1=CC(=C(C(=C1)C(=O)O)N=[N+]=[N-])C(=O)O
Structure:
CAS RN: 42908-86-1
CAS Name: 2-(chloromethyl)benzoyl chloride
OPENEYE Name: 2-(chloromethyl)benzoyl chloride
IUPAC Name: 2-(chloromethyl)benzoyl chloride
SYSTEMATIC NAME: 2-(chloromethyl)benzoyl chloride
MOLECULAR FORMULA: C8H6Cl2O
MOLECULAR WEIGHT: 189.03864
SMILES: C1=CC=C(C(=C1)CCl)C(=O)Cl
Structure:
CAS RN: 42902-52-3
CAS Name: 3-(3-methylanilino)propane-1,2-diol
OPENEYE Name: 3-(3-methylanilino)propane-1,2-diol
IUPAC Name: 3-(3-methylanilino)propane-1,2-diol
SYSTEMATIC NAME: 3-[(3-methylphenyl)amino]propane-1,2-diol
MOLECULAR FORMULA: C10H15NO2
MOLECULAR WEIGHT: 181.2316
SMILES: CC1=CC(=CC=C1)NCC(CO)O
Structure:
No comments:
Post a Comment