Wednesday, July 4, 2012

http://ChemLookup.com Compounds




CAS RN: 71639-08-2
CAS Name: 3',6'-bis(dimethylamino)-1-spiro[isobenzofuran-3,9'-xanthene]one
OPENEYE Name: 3',6'-bis(dimethylamino)spiro[isobenzofuran-3,9'-xanthene]-1-one
IUPAC Name: 3',6'-bis(dimethylamino)spiro[2-benzofuran-3,9'-xanthene]-1-one
SYSTEMATIC NAME: 3',6'-bis(dimethylamino)spiro[2-benzofuran-3,9'-xanthene]-1-one
MOLECULAR FORMULA: C24H22N2O3
MOLECULAR WEIGHT: 386.44308
SMILES: CN(C)C1=CC2=C(C=C1)C3(C4=C(O2)C=C(C=C4)N(C)C)C5=CC=CC=C5C(=O)O3
Structure:

CAS RN: 174-81-2
CAS Name: 2,6-dithiaspiro[3.3]heptane
OPENEYE Name: 2,6-dithiaspiro[3.3]heptane
IUPAC Name: 2,6-dithiaspiro[3.3]heptane
SYSTEMATIC NAME: 2,6-dithiaspiro[3.3]heptane
MOLECULAR FORMULA: C5H8S2
MOLECULAR WEIGHT: 132.24702
SMILES: C1C2(CS1)CSC2
Structure:

CAS RN: 87442-40-8
CAS Name: 2$l^{4},6$l^{4}-dithiaspiro[3.3]heptane 2,6-dioxide
OPENEYE Name: 2$l^{4},6$l^{4}-dithiaspiro[3.3]heptane 2,6-dioxide
IUPAC Name: 2$l^{4},6$l^{4}-dithiaspiro[3.3]heptane 2,6-dioxide
SYSTEMATIC NAME: 2$l^{4},6$l^{4}-dithiaspiro[3.3]heptane 2,6-dioxide
MOLECULAR FORMULA: C5H8O2S2
MOLECULAR WEIGHT: 164.24582
SMILES: C1C2(CS1=O)CS(=O)C2
Structure:

CAS RN: 725-92-8
CAS Name: 4-oxopyran-2,6-dicarboxylic acid diethyl ester
OPENEYE Name: diethyl 4-oxopyran-2,6-dicarboxylate
IUPAC Name: diethyl 4-oxopyran-2,6-dicarboxylate
SYSTEMATIC NAME: diethyl 4-oxidanylidenepyran-2,6-dicarboxylate
MOLECULAR FORMULA: C11H12O6
MOLECULAR WEIGHT: 240.20938
SMILES: CCOC(=O)C1=CC(=O)C=C(O1)C(=O)OCC
Structure:

CAS RN: 65818-64-6
CAS Name: 3,4-diphenylthiophene-2,5-dicarboxylic acid diethyl ester
OPENEYE Name: diethyl 3,4-diphenylthiophene-2,5-dicarboxylate
IUPAC Name: diethyl 3,4-diphenylthiophene-2,5-dicarboxylate
SYSTEMATIC NAME: diethyl 3,4-diphenylthiophene-2,5-dicarboxylate
MOLECULAR FORMULA: C22H20O4S
MOLECULAR WEIGHT: 380.4568
SMILES: CCOC(=O)C1=C(C(=C(S1)C(=O)OCC)C2=CC=CC=C2)C3=CC=CC=C3
Structure:

CAS RN: 17773-22-7
CAS Name: thiolane-2,5-dicarboxylic acid
OPENEYE Name: tetrahydrothiophene-2,5-dicarboxylic acid
IUPAC Name: thiolane-2,5-dicarboxylic acid
SYSTEMATIC NAME: thiolane-2,5-dicarboxylic acid
MOLECULAR FORMULA: C6H8O4S
MOLECULAR WEIGHT: 176.19032
SMILES: C1CC(SC1C(=O)O)C(=O)O
Structure:

CAS RN: 24526-73-6
CAS Name: 2-(2-oxo-1-benzopyran-4-yl)acetic acid
OPENEYE Name: 2-(2-oxochromen-4-yl)acetic acid
IUPAC Name: 2-(2-oxochromen-4-yl)acetic acid
SYSTEMATIC NAME: 2-(2-oxidanylidenechromen-4-yl)ethanoic acid
MOLECULAR FORMULA: C11H8O4
MOLECULAR WEIGHT: 204.17882
SMILES: C1=CC=C2C(=C1)C(=CC(=O)O2)CC(=O)O
Structure:

CAS RN: 51037-16-2
CAS Name: 3a,3b,4,5,6,7,8,9,10,11,11a,11b-dodecahydrophenanthro[9,10-c]furan-1,3-dione
OPENEYE Name: 3a,3b,4,5,6,7,8,9,10,11,11a,11b-dodecahydrophenanthro[9,10-c]furan-1,3-dione
IUPAC Name: 3a,3b,4,5,6,7,8,9,10,11,11a,11b-dodecahydrophenanthro[9,10-c]furan-1,3-dione
SYSTEMATIC NAME: 3a,3b,4,5,6,7,8,9,10,11,11a,11b-dodecahydrophenanthro[9,10-c]furan-1,3-dione
MOLECULAR FORMULA: C16H20O3
MOLECULAR WEIGHT: 260.3282
SMILES: C1CCC2=C3CCCCC3C4C(C2C1)C(=O)OC4=O
Structure:

CAS RN: 92915-78-1
CAS Name: 2-(2-furanyl)-2-propenoic acid
OPENEYE Name: 2-(2-furyl)prop-2-enoic acid
IUPAC Name: 2-(furan-2-yl)prop-2-enoic acid
SYSTEMATIC NAME: 2-(furan-2-yl)prop-2-enoic acid
MOLECULAR FORMULA: C7H6O3
MOLECULAR WEIGHT: 138.12074
SMILES: C=C(C1=CC=CO1)C(=O)O
Structure:

CAS RN: 5661-51-8
CAS Name: N-(phenylhydrazinylidene)acetamide
OPENEYE Name: N-(phenylhydrazono)acetamide
IUPAC Name: N-(phenylhydrazinylidene)acetamide
SYSTEMATIC NAME: N-(phenylhydrazinylidene)ethanamide
MOLECULAR FORMULA: C8H9N3O
MOLECULAR WEIGHT: 163.17656
SMILES: CC(=O)N=NNC1=CC=CC=C1
Structure:

CAS RN: 10146-04-0
CAS Name: 1-(4-methylphenyl)azo-2-naphthalenamine
OPENEYE Name: 1-(p-tolylazo)naphthalen-2-amine
IUPAC Name: 1-[(4-methylphenyl)diazenyl]naphthalen-2-amine
SYSTEMATIC NAME: 1-[(4-methylphenyl)diazenyl]naphthalen-2-amine
MOLECULAR FORMULA: C17H15N3
MOLECULAR WEIGHT: 261.3211
SMILES: CC1=CC=C(C=C1)N=NC2=C(C=CC3=CC=CC=C32)N
Structure:

CAS RN: 59417-03-7
CAS Name: 1-phenyl-N-[4-[(phenylmethylene)amino]-1-piperazinyl]methanimine
OPENEYE Name: N-[4-(benzylideneamino)piperazin-1-yl]-1-phenyl-methanimine
IUPAC Name: N-[4-(benzylideneamino)piperazin-1-yl]-1-phenylmethanimine
SYSTEMATIC NAME: 1-phenyl-N-[4-[(phenylmethylidene)amino]piperazin-1-yl]methanimine
MOLECULAR FORMULA: C18H20N4
MOLECULAR WEIGHT: 292.3782
SMILES: C1CN(CCN1N=CC2=CC=CC=C2)N=CC3=CC=CC=C3
Structure:

CAS RN: 790-48-7
CAS Name: N-methyl-N-[(4-nitrophenyl)methylideneamino]aniline
OPENEYE Name: N-methyl-N-[(4-nitrophenyl)methyleneamino]aniline
IUPAC Name: N-methyl-N-[(4-nitrophenyl)methylideneamino]aniline
SYSTEMATIC NAME: N-methyl-N-[(4-nitrophenyl)methylideneamino]aniline
MOLECULAR FORMULA: C14H13N3O2
MOLECULAR WEIGHT: 255.27192
SMILES: CN(C1=CC=CC=C1)N=CC2=CC=C(C=C2)[N+](=O)[O-]
Structure:

CAS RN: 23718-94-7
CAS Name: N-methyl-N-[(2-nitrophenyl)methylideneamino]aniline
OPENEYE Name: N-methyl-N-[(2-nitrophenyl)methyleneamino]aniline
IUPAC Name: N-methyl-N-[(2-nitrophenyl)methylideneamino]aniline
SYSTEMATIC NAME: N-methyl-N-[(2-nitrophenyl)methylideneamino]aniline
MOLECULAR FORMULA: C14H13N3O2
MOLECULAR WEIGHT: 255.27192
SMILES: CN(C1=CC=CC=C1)N=CC2=CC=CC=C2[N+](=O)[O-]
Structure:

CAS RN: 4371-30-6
CAS Name: 4-(2,4-diaminophenyl)benzene-1,3-diamine
OPENEYE Name: 4-(2,4-diaminophenyl)benzene-1,3-diamine
IUPAC Name: 4-(2,4-diaminophenyl)benzene-1,3-diamine
SYSTEMATIC NAME: 4-[2,4-bis(azanyl)phenyl]benzene-1,3-diamine
MOLECULAR FORMULA: C12H14N4
MOLECULAR WEIGHT: 214.26636
SMILES: C1=CC(=C(C=C1N)N)C2=C(C=C(C=C2)N)N
Structure:

CAS RN: 59907-22-1
CAS Name: N-(2-methyl-6-nitrophenyl)acetamide
OPENEYE Name: N-(2-methyl-6-nitro-phenyl)acetamide
IUPAC Name: N-(2-methyl-6-nitrophenyl)acetamide
SYSTEMATIC NAME: N-(2-methyl-6-nitro-phenyl)ethanamide
MOLECULAR FORMULA: C9H10N2O3
MOLECULAR WEIGHT: 194.1873
SMILES: CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)C
Structure:

CAS RN: 81262-51-3
CAS Name: N-(2-amino-4-methylphenyl)benzenesulfonamide
OPENEYE Name: N-(2-amino-4-methyl-phenyl)benzenesulfonamide
IUPAC Name: N-(2-amino-4-methylphenyl)benzenesulfonamide
SYSTEMATIC NAME: N-(2-azanyl-4-methyl-phenyl)benzenesulfonamide
MOLECULAR FORMULA: C13H14N2O2S
MOLECULAR WEIGHT: 262.32746
SMILES: CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=CC=C2)N
Structure:

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