Wednesday, July 25, 2012

http://ChemLookup.com Compounds




CAS RN: 15561-33-8
CAS Name: methanesulfonic acid [5-(5-fluoro-2,4-dioxo-1-pyrimidinyl)-2-(hydroxymethyl)-3-oxolanyl] ester
OPENEYE Name: [5-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl] methanesulfonate
IUPAC Name: [5-(5-fluoro-2,4-dioxopyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl] methanesulfonate
SYSTEMATIC NAME: [5-[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-(hydroxymethyl)oxolan-3-yl] methanesulfonate
MOLECULAR FORMULA: C10H13FN2O7S
MOLECULAR WEIGHT: 324.282823
SMILES: CS(=O)(=O)OC1CC(OC1CO)N2C=C(C(=O)NC2=O)F
Structure:

CAS RN: 7780-33-8
CAS Name: 5-methyl-1,2-bis(phenylmethyl)-3-pyrazolone; 2,4,6-trinitrophenol
OPENEYE Name: 1,2-dibenzyl-5-methyl-pyrazol-3-one; picric acid
IUPAC Name: 1,2-dibenzyl-5-methylpyrazol-3-one; 2,4,6-trinitrophenol
SYSTEMATIC NAME: 5-methyl-1,2-bis(phenylmethyl)pyrazol-3-one; 2,4,6-trinitrophenol
MOLECULAR FORMULA: C24H21N5O8
MOLECULAR WEIGHT: 507.45224
SMILES: CC1=CC(=O)N(N1CC2=CC=CC=C2)CC3=CC=CC=C3.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]
Structure:

CAS RN: 76185-56-3
CAS Name: 1-(cyclohexylamino)-2-methyl-2-propanol
OPENEYE Name: 1-(cyclohexylamino)-2-methyl-propan-2-ol
IUPAC Name: 1-(cyclohexylamino)-2-methylpropan-2-ol
SYSTEMATIC NAME: 1-(cyclohexylamino)-2-methyl-propan-2-ol
MOLECULAR FORMULA: C10H21NO
MOLECULAR WEIGHT: 171.27984
SMILES: CC(C)(CNC1CCCCC1)O
Structure:

CAS RN: 27840-90-0
CAS Name: 2-(cyclohexylamino)-1-propanol
OPENEYE Name: 2-(cyclohexylamino)propan-1-ol
IUPAC Name: 2-(cyclohexylamino)propan-1-ol
SYSTEMATIC NAME: 2-(cyclohexylamino)propan-1-ol
MOLECULAR FORMULA: C9H19NO
MOLECULAR WEIGHT: 157.25326
SMILES: CC(CO)NC1CCCCC1
Structure:

CAS RN: 83680-83-5
CAS Name: 2-ethyl-2,4,4-trimethyloxazolidine
OPENEYE Name: 2-ethyl-2,4,4-trimethyl-oxazolidine
IUPAC Name: 2-ethyl-2,4,4-trimethyl-1,3-oxazolidine
SYSTEMATIC NAME: 2-ethyl-2,4,4-trimethyl-1,3-oxazolidine
MOLECULAR FORMULA: C8H17NO
MOLECULAR WEIGHT: 143.22668
SMILES: CCC1(NC(CO1)(C)C)C
Structure:

CAS RN: 69781-63-1
CAS Name: 4-aminobenzoic acid 1-(cyclohexylamino)propan-2-yl ester; 2-hydroxyacetic acid
OPENEYE Name: [2-(cyclohexylamino)-1-methyl-ethyl] 4-aminobenzoate; 2-hydroxyacetic acid
IUPAC Name: 1-(cyclohexylamino)propan-2-yl 4-aminobenzoate; 2-hydroxyacetic acid
SYSTEMATIC NAME: 1-(cyclohexylamino)propan-2-yl 4-azanylbenzoate; 2-oxidanylethanoic acid
MOLECULAR FORMULA: C18H28N2O5
MOLECULAR WEIGHT: 352.42532
SMILES: CC(CNC1CCCCC1)OC(=O)C2=CC=C(C=C2)N.C(C(=O)O)O
Structure:

CAS RN: 2888-11-1
CAS Name: 3-cyclopentylpropylbenzene
OPENEYE Name: 3-cyclopentylpropylbenzene
IUPAC Name: 3-cyclopentylpropylbenzene
SYSTEMATIC NAME: 3-cyclopentylpropylbenzene
MOLECULAR FORMULA: C14H20
MOLECULAR WEIGHT: 188.3086
SMILES: C1CCC(C1)CCCC2=CC=CC=C2
Structure:

CAS RN: 5574-80-1
CAS Name: 1,3-didecylcyclohexane
OPENEYE Name: 1,3-didecylcyclohexane
IUPAC Name: 1,3-didecylcyclohexane
SYSTEMATIC NAME: 1,3-didecylcyclohexane
MOLECULAR FORMULA: C26H52
MOLECULAR WEIGHT: 364.69108
SMILES: CCCCCCCCCCC1CCCC(C1)CCCCCCCCCC
Structure:

CAS RN: 40281-11-6
CAS Name: 2-(4-bromophenyl)sulfinylacetic acid
OPENEYE Name: 2-(4-bromophenyl)sulfinylacetic acid
IUPAC Name: 2-(4-bromophenyl)sulfinylacetic acid
SYSTEMATIC NAME: 2-(4-bromophenyl)sulfinylethanoic acid
MOLECULAR FORMULA: C8H7BrO3S
MOLECULAR WEIGHT: 263.10838
SMILES: C1=CC(=CC=C1S(=O)CC(=O)O)Br
Structure:

CAS RN: 26690-09-5
CAS Name: 1-(methoxymethyl)-6-nitro-2H-3,1-benzoxazin-4-one
OPENEYE Name: 1-(methoxymethyl)-6-nitro-2H-3,1-benzoxazin-4-one
IUPAC Name: 1-(methoxymethyl)-6-nitro-2H-3,1-benzoxazin-4-one
SYSTEMATIC NAME: 1-(methoxymethyl)-6-nitro-2H-3,1-benzoxazin-4-one
MOLECULAR FORMULA: C10H10N2O5
MOLECULAR WEIGHT: 238.1968
SMILES: COCN1COC(=O)C2=C1C=CC(=C2)[N+](=O)[O-]
Structure:

CAS RN: 1597-01-9
CAS Name: 6-methyl-5-(4-phenylbutyl)pyrimidine-2,4-diamine
OPENEYE Name: 6-methyl-5-(4-phenylbutyl)pyrimidine-2,4-diamine
IUPAC Name: 6-methyl-5-(4-phenylbutyl)pyrimidine-2,4-diamine
SYSTEMATIC NAME: 6-methyl-5-(4-phenylbutyl)pyrimidine-2,4-diamine
MOLECULAR FORMULA: C15H20N4
MOLECULAR WEIGHT: 256.3461
SMILES: CC1=C(C(=NC(=N1)N)N)CCCCC2=CC=CC=C2
Structure:

CAS RN: 24230-01-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H10O3
MOLECULAR WEIGHT: 202.206
SMILES: CC12CC(C(=O)C3=CC=CC=C31)OC2=O
Structure:

CAS RN: 24314-25-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H10O3
MOLECULAR WEIGHT: 202.206
SMILES: CC12CC(C(=O)C3=CC=CC=C31)OC2=O
Structure:

CAS RN: 5339-95-7
CAS Name: 1-(diaminomethylidene)-2-(6-methoxy-8-quinolinyl)guanidine
OPENEYE Name: 1-(diaminomethylene)-2-(6-methoxy-8-quinolyl)guanidine
IUPAC Name: 1-(diaminomethylidene)-2-(6-methoxyquinolin-8-yl)guanidine
SYSTEMATIC NAME: 1-[bis(azanyl)methylidene]-2-(6-methoxyquinolin-8-yl)guanidine
MOLECULAR FORMULA: C12H14N6O
MOLECULAR WEIGHT: 258.27916
SMILES: COC1=CC(=C2C(=C1)C=CC=N2)N=C(N)N=C(N)N
Structure:

CAS RN: 80789-71-5
CAS Name: 2-(4-fluorosulfonylphenyl)-4-oxo-1H-quinoline-6-carboxylic acid ethyl ester
OPENEYE Name: ethyl 2-(4-fluorosulfonylphenyl)-4-oxo-1H-quinoline-6-carboxylate
IUPAC Name: ethyl 2-(4-fluorosulfonylphenyl)-4-oxo-1H-quinoline-6-carboxylate
SYSTEMATIC NAME: ethyl 2-(4-fluorosulfonylphenyl)-4-oxidanylidene-1H-quinoline-6-carboxylate
MOLECULAR FORMULA: C18H14FNO5S
MOLECULAR WEIGHT: 375.370863
SMILES: CCOC(=O)C1=CC2=C(C=C1)NC(=CC2=O)C3=CC=C(C=C3)S(=O)(=O)F
Structure:

CAS RN: 23269-92-3
CAS Name: 5,11-dimethyl-3,4-dihydro-[1]benzothiolo[3,2-g]isoquinoline
OPENEYE Name: 5,11-dimethyl-3,4-dihydrobenzothiopheno[3,2-g]isoquinoline
IUPAC Name: 5,11-dimethyl-3,4-dihydro-[1]benzothiolo[3,2-g]isoquinoline
SYSTEMATIC NAME: 5,11-dimethyl-3,4-dihydro-[1]benzothiolo[3,2-g]isoquinoline
MOLECULAR FORMULA: C17H15NS
MOLECULAR WEIGHT: 265.3727
SMILES: CC1=C2C3=CC=CC=C3SC2=C(C4=C1CCN=C4)C
Structure:

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