Saturday, April 27, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2-[(E)-2-ethoxybut-1-enyl]-3-ethyl-5-methyl-1,3-benzotellurazol-3-ium
CAS Name: 2-[(E)-2-ethoxybut-1-enyl]-3-ethyl-5-methyl-1,3-benzotellurazol-3-ium
IUPAC NAME: 2-[(E)-2-ethoxybut-1-enyl]-3-ethyl-5-methyl-1,3-benzotellurazol-3-ium
SYSTEMATIC NAME: 2-[(E)-2-ethoxybut-1-enyl]-3-ethyl-5-methyl-1,3-benzotellurazol-3-ium
MOLECULAR FORMULA: C16H22NOTe+
MOLECULAR WEIGHT: 371.95198
SMILES: CC/C(=C\C1=[N+](C2=C([Te]1)C=CC(=C2)C)CC)/OCC
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Product OPENEYE NAME: (1Z)-1-(3-ethyl-5-methyl-1,3-benzotellurazol-2-ylidene)butan-2-one
CAS Name: (1Z)-1-(3-ethyl-5-methyl-1,3-benzotellurazol-2-ylidene)-2-butanone
IUPAC NAME: (1Z)-1-(3-ethyl-5-methyl-1,3-benzotellurazol-2-ylidene)butan-2-one
SYSTEMATIC NAME: (1Z)-1-(3-ethyl-5-methyl-1,3-benzotellurazol-2-ylidene)butan-2-one
MOLECULAR FORMULA: C14H17NOTe
MOLECULAR WEIGHT: 342.89088
SMILES: CCC(=O)/C=C\1/N(C2=C([Te]1)C=CC(=C2)C)CC
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Product OPENEYE NAME: 4-[ethyl-[2-(N-ethyl-4-formyl-anilino)ethyl]amino]benzaldehyde
CAS Name: 4-[ethyl-[2-(N-ethyl-4-formylanilino)ethyl]amino]benzaldehyde
IUPAC NAME: 4-[ethyl-[2-(N-ethyl-4-formylanilino)ethyl]amino]benzaldehyde
SYSTEMATIC NAME: 4-[ethyl-[2-[ethyl-(4-methanoylphenyl)amino]ethyl]amino]benzaldehyde
MOLECULAR FORMULA: C20H24N2O2
MOLECULAR WEIGHT: 324.41676
SMILES: CCN(CCN(CC)C1=CC=C(C=C1)C=O)C2=CC=C(C=C2)C=O
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Product OPENEYE NAME: 2-methyl-N-(methylcarbamoyl)prop-2-enamide
CAS Name: 2-methyl-N-(methylcarbamoyl)-2-propenamide
IUPAC NAME: 2-methyl-N-(methylcarbamoyl)prop-2-enamide
SYSTEMATIC NAME: 2-methyl-N-(methylcarbamoyl)prop-2-enamide
MOLECULAR FORMULA: C6H10N2O2
MOLECULAR WEIGHT: 142.1558
SMILES: CC(=C)C(=O)NC(=O)NC
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Product OPENEYE NAME: N-(allylcarbamoyl)-2-methyl-prop-2-enamide
CAS Name: 2-methyl-N-[oxo-(prop-2-enylamino)methyl]-2-propenamide
IUPAC NAME: 2-methyl-N-(prop-2-enylcarbamoyl)prop-2-enamide
SYSTEMATIC NAME: 2-methyl-N-(prop-2-enylcarbamoyl)prop-2-enamide
MOLECULAR FORMULA: C8H12N2O2
MOLECULAR WEIGHT: 168.19308
SMILES: CC(=C)C(=O)NC(=O)NCC=C
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Product OPENEYE NAME: 2-methyl-N-(thiazol-2-ylcarbamoyl)prop-2-enamide
CAS Name: 2-methyl-N-[oxo-(2-thiazolylamino)methyl]-2-propenamide
IUPAC NAME: 2-methyl-N-(1,3-thiazol-2-ylcarbamoyl)prop-2-enamide
SYSTEMATIC NAME: 2-methyl-N-(1,3-thiazol-2-ylcarbamoyl)prop-2-enamide
MOLECULAR FORMULA: C8H9N3O2S
MOLECULAR WEIGHT: 211.24096
SMILES: CC(=C)C(=O)NC(=O)NC1=NC=CS1
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Product OPENEYE NAME: N-(dicyclohexylcarbamoyl)-2-methyl-prop-2-enamide
CAS Name: N-[(dicyclohexylamino)-oxomethyl]-2-methyl-2-propenamide
IUPAC NAME: N-(dicyclohexylcarbamoyl)-2-methylprop-2-enamide
SYSTEMATIC NAME: N-(dicyclohexylcarbamoyl)-2-methyl-prop-2-enamide
MOLECULAR FORMULA: C17H28N2O2
MOLECULAR WEIGHT: 292.41642
SMILES: CC(=C)C(=O)NC(=O)N(C1CCCCC1)C2CCCCC2
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Product OPENEYE NAME: N-(dimethylcarbamoyl)-2-methyl-prop-2-enamide
CAS Name: N-[dimethylamino(oxo)methyl]-2-methyl-2-propenamide
IUPAC NAME: N-(dimethylcarbamoyl)-2-methylprop-2-enamide
SYSTEMATIC NAME: N-(dimethylcarbamoyl)-2-methyl-prop-2-enamide
MOLECULAR FORMULA: C7H12N2O2
MOLECULAR WEIGHT: 156.18238
SMILES: CC(=C)C(=O)NC(=O)N(C)C
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Product OPENEYE NAME: N-(2-methylprop-2-enoyl)morpholine-4-carboxamide
CAS Name: N-(2-methyl-1-oxoprop-2-enyl)-4-morpholinecarboxamide
IUPAC NAME: N-(2-methylprop-2-enoyl)morpholine-4-carboxamide
SYSTEMATIC NAME: N-(2-methylprop-2-enoyl)morpholine-4-carboxamide
MOLECULAR FORMULA: C9H14N2O3
MOLECULAR WEIGHT: 198.21906
SMILES: CC(=C)C(=O)NC(=O)N1CCOCC1
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Product OPENEYE NAME: ethyl 4-[4-(1-methylheptoxy)phenyl]benzoate
CAS Name: 4-(4-octan-2-yloxyphenyl)benzoic acid ethyl ester
IUPAC NAME: ethyl 4-(4-octan-2-yloxyphenyl)benzoate
SYSTEMATIC NAME: ethyl 4-(4-octan-2-yloxyphenyl)benzoate
MOLECULAR FORMULA: C23H30O3
MOLECULAR WEIGHT: 354.4825
SMILES: CCCCCCC(C)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCC
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Product OPENEYE NAME: 4-[4-(1-methylheptoxy)phenyl]benzoic acid
CAS Name: 4-(4-octan-2-yloxyphenyl)benzoic acid
IUPAC NAME: 4-(4-octan-2-yloxyphenyl)benzoic acid
SYSTEMATIC NAME: 4-(4-octan-2-yloxyphenyl)benzoic acid
MOLECULAR FORMULA: C21H26O3
MOLECULAR WEIGHT: 326.42934
SMILES: CCCCCCC(C)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
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Product OPENEYE NAME: 4-[4-(1-methylheptoxy)phenyl]benzoyl chloride
CAS Name: 4-(4-octan-2-yloxyphenyl)benzoyl chloride
IUPAC NAME: 4-(4-octan-2-yloxyphenyl)benzoyl chloride
SYSTEMATIC NAME: 4-(4-octan-2-yloxyphenyl)benzoyl chloride
MOLECULAR FORMULA: C21H25ClO2
MOLECULAR WEIGHT: 344.875
SMILES: CCCCCCC(C)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)Cl
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Product OPENEYE NAME: (4-octoxyphenyl) 4-[4-(1-methylheptoxy)phenyl]benzoate
CAS Name: 4-(4-octan-2-yloxyphenyl)benzoic acid (4-octoxyphenyl) ester
IUPAC NAME: (4-octoxyphenyl) 4-(4-octan-2-yloxyphenyl)benzoate
SYSTEMATIC NAME: (4-octoxyphenyl) 4-(4-octan-2-yloxyphenyl)benzoate
MOLECULAR FORMULA: C35H46O4
MOLECULAR WEIGHT: 530.73734
SMILES: CCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(C)CCCCCC
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Product OPENEYE NAME: N-hexadecyl-1-hydroxy-4-(2-methylsulfonylethoxy)naphthalene-2-carboxamide
CAS Name: N-hexadecyl-1-hydroxy-4-(2-methylsulfonylethoxy)-2-naphthalenecarboxamide
IUPAC NAME: N-hexadecyl-1-hydroxy-4-(2-methylsulfonylethoxy)naphthalene-2-carboxamide
SYSTEMATIC NAME: N-hexadecyl-4-(2-methylsulfonylethoxy)-1-oxidanyl-naphthalene-2-carboxamide
MOLECULAR FORMULA: C30H47NO5S
MOLECULAR WEIGHT: 533.76288
SMILES: CCCCCCCCCCCCCCCCNC(=O)C1=C(C2=CC=CC=C2C(=C1)OCCS(=O)(=O)C)O
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Product OPENEYE NAME: N-[4-[3-(7-chloro-6-methyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)propyl]phenyl]-2-methyl-prop-2-enamide
CAS Name: N-[4-[3-(7-chloro-6-methyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)propyl]phenyl]-2-methyl-2-propenamide
IUPAC NAME: N-[4-[3-(7-chloro-6-methyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)propyl]phenyl]-2-methylprop-2-enamide
SYSTEMATIC NAME: N-[4-[3-(7-chloranyl-6-methyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)propyl]phenyl]-2-methyl-prop-2-enamide
MOLECULAR FORMULA: C18H20ClN5O
MOLECULAR WEIGHT: 357.8373
SMILES: CC1=C(C2=NN=C(N2N1)CCCC3=CC=C(C=C3)NC(=O)C(=C)C)Cl
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Product OPENEYE NAME: 1',3',3'-trimethyl-5-nitro-spiro[chromene-2,2'-indoline]
CAS Name: 1',3',3'-trimethyl-5-nitrospiro[1-benzopyran-2,2'-indole]
IUPAC NAME: 1',3',3'-trimethyl-5-nitrospiro[chromene-2,2'-indole]
SYSTEMATIC NAME: 1',3',3'-trimethyl-5-nitro-spiro[chromene-2,2'-indole]
MOLECULAR FORMULA: C19H18N2O3
MOLECULAR WEIGHT: 322.35782
SMILES: CC1(C2=CC=CC=C2N(C13C=CC4=C(C=CC=C4O3)[N+](=O)[O-])C)C
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Product OPENEYE NAME: 1H-benzimidazol-4-yl carbamate
CAS Name: carbamic acid 1H-benzimidazol-4-yl ester
IUPAC NAME: 1H-benzimidazol-4-yl carbamate
SYSTEMATIC NAME: 1H-benzimidazol-4-yl carbamate
MOLECULAR FORMULA: C8H7N3O2
MOLECULAR WEIGHT: 177.16008
SMILES: C1=CC2=C(C(=C1)OC(=O)N)N=CN2
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Product OPENEYE NAME: 1,5-bis(4-methoxyanilino)anthracene-9,10-dione
CAS Name: 1,5-bis(4-methoxyanilino)anthracene-9,10-dione
IUPAC NAME: 1,5-bis(4-methoxyanilino)anthracene-9,10-dione
SYSTEMATIC NAME: 1,5-bis[(4-methoxyphenyl)amino]anthracene-9,10-dione
MOLECULAR FORMULA: C28H22N2O4
MOLECULAR WEIGHT: 450.48528
SMILES: COC1=CC=C(C=C1)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC5=CC=C(C=C5)OC
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Product OPENEYE NAME: 5-hexyl-2-(4-isothiocyanatophenyl)pyrimidine
CAS Name: 5-hexyl-2-(4-isothiocyanatophenyl)pyrimidine
IUPAC NAME: 5-hexyl-2-(4-isothiocyanatophenyl)pyrimidine
SYSTEMATIC NAME: 5-hexyl-2-(4-isothiocyanatophenyl)pyrimidine
MOLECULAR FORMULA: C17H19N3S
MOLECULAR WEIGHT: 297.41786
SMILES: CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)N=C=S
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