Saturday, July 21, 2012

http://ChemLookup.com Compounds




CAS RN: 6265-27-6
CAS Name: 4-cyclohexylbuta-1,3-diynylcyclohexane
OPENEYE Name: 4-cyclohexylbuta-1,3-diynylcyclohexane
IUPAC Name: 4-cyclohexylbuta-1,3-diynylcyclohexane
SYSTEMATIC NAME: 4-cyclohexylbuta-1,3-diynylcyclohexane
MOLECULAR FORMULA: C16H22
MOLECULAR WEIGHT: 214.34588
SMILES: C1CCC(CC1)C#CC#CC2CCCCC2
Structure:

CAS RN: 57078-97-4
CAS Name: 1-cyclohexylhex-1-enylcyclohexane
OPENEYE Name: 1-cyclohexylhex-1-enylcyclohexane
IUPAC Name: 1-cyclohexylhex-1-enylcyclohexane
SYSTEMATIC NAME: 1-cyclohexylhex-1-enylcyclohexane
MOLECULAR FORMULA: C18H32
MOLECULAR WEIGHT: 248.44668
SMILES: CCCCC=C(C1CCCCC1)C2CCCCC2
Structure:

CAS RN: 22031-56-7
CAS Name: 2-heptenenitrile
OPENEYE Name: hept-2-enenitrile
IUPAC Name: hept-2-enenitrile
SYSTEMATIC NAME: hept-2-enenitrile
MOLECULAR FORMULA: C7H11N
MOLECULAR WEIGHT: 109.16894
SMILES: CCCCC=CC#N
Structure:

CAS RN: 33744-29-5
CAS Name: 3-chloroprop-1-ynylbenzene
OPENEYE Name: 3-chloroprop-1-ynylbenzene
IUPAC Name: 3-chloroprop-1-ynylbenzene
SYSTEMATIC NAME: 3-chloranylprop-1-ynylbenzene
MOLECULAR FORMULA: C9H7Cl
MOLECULAR WEIGHT: 150.60488
SMILES: C1=CC=C(C=C1)C#CCCl
Structure:

CAS RN: 220-82-6
CAS Name: 1-(2-bromoethynyl)cyclohexene
OPENEYE Name: 1-(2-bromoethynyl)cyclohexene
IUPAC Name: 1-(2-bromoethynyl)cyclohexene
SYSTEMATIC NAME: 1-(2-bromanylethynyl)cyclohexene
MOLECULAR FORMULA: C8H9Br
MOLECULAR WEIGHT: 185.06106
SMILES: C1CCC(=CC1)C#CBr
Structure:

CAS RN: 67461-76-1
CAS Name: 2-bromoethynylcyclohexane
OPENEYE Name: 2-bromoethynylcyclohexane
IUPAC Name: 2-bromoethynylcyclohexane
SYSTEMATIC NAME: 2-bromanylethynylcyclohexane
MOLECULAR FORMULA: C8H11Br
MOLECULAR WEIGHT: 187.07694
SMILES: C1CCC(CC1)C#CBr
Structure:

CAS RN: 6144-81-6
CAS Name: 2-(4-nitrophenyl)acetohydrazide
OPENEYE Name: 2-(4-nitrophenyl)acetohydrazide
IUPAC Name: 2-(4-nitrophenyl)acetohydrazide
SYSTEMATIC NAME: 2-(4-nitrophenyl)ethanehydrazide
MOLECULAR FORMULA: C8H9N3O3
MOLECULAR WEIGHT: 195.17536
SMILES: C1=CC(=CC=C1CC(=O)NN)[N+](=O)[O-]
Structure:

CAS RN: 5081-37-8
CAS Name: 3-methoxy-4-nitrobenzoic acid methyl ester
OPENEYE Name: methyl 3-methoxy-4-nitro-benzoate
IUPAC Name: methyl 3-methoxy-4-nitrobenzoate
SYSTEMATIC NAME: methyl 3-methoxy-4-nitro-benzoate
MOLECULAR FORMULA: C9H9NO5
MOLECULAR WEIGHT: 211.17146
SMILES: COC1=C(C=CC(=C1)C(=O)OC)[N+](=O)[O-]
Structure:

CAS RN: 21293-29-8
CAS Name: 5-(1-hydroxy-2,6,6-trimethyl-4-oxo-1-cyclohex-2-enyl)-3-methylpenta-2,4-dienoic acid
OPENEYE Name: 5-(1-hydroxy-2,6,6-trimethyl-4-oxo-cyclohex-2-en-1-yl)-3-methyl-penta-2,4-dienoic acid
IUPAC Name: 5-(1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)-3-methylpenta-2,4-dienoic acid
SYSTEMATIC NAME: 3-methyl-5-(2,6,6-trimethyl-1-oxidanyl-4-oxidanylidene-cyclohex-2-en-1-yl)penta-2,4-dienoic acid
MOLECULAR FORMULA: C15H20O4
MOLECULAR WEIGHT: 264.3169
SMILES: CC1=CC(=O)CC(C1(C=CC(=CC(=O)O)C)O)(C)C
Structure:

CAS RN: 50817-04-4
CAS Name: 2,3-diaminobutanedioic acid
OPENEYE Name: 2,3-diaminobutanedioic acid
IUPAC Name: 2,3-diaminobutanedioic acid
SYSTEMATIC NAME: 2,3-bis(azanyl)butanedioic acid
MOLECULAR FORMULA: C4H8N2O4
MOLECULAR WEIGHT: 148.11732
SMILES: C(C(C(=O)O)N)(C(=O)O)N
Structure:

CAS RN: 37707-85-0
CAS Name: 2-(6,7-dimethoxy-2-naphthalenyl)acetamide
OPENEYE Name: 2-(6,7-dimethoxy-2-naphthyl)acetamide
IUPAC Name: 2-(6,7-dimethoxynaphthalen-2-yl)acetamide
SYSTEMATIC NAME: 2-(6,7-dimethoxynaphthalen-2-yl)ethanamide
MOLECULAR FORMULA: C14H15NO3
MOLECULAR WEIGHT: 245.2738
SMILES: COC1=C(C=C2C=C(C=CC2=C1)CC(=O)N)OC
Structure:

CAS RN: 37938-82-2
CAS Name: 1-[(6,7-dimethoxy-2-naphthalenyl)methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline
OPENEYE Name: 1-[(6,7-dimethoxy-2-naphthyl)methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline
IUPAC Name: 1-[(6,7-dimethoxynaphthalen-2-yl)methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline
SYSTEMATIC NAME: 1-[(6,7-dimethoxynaphthalen-2-yl)methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline
MOLECULAR FORMULA: C24H25NO4
MOLECULAR WEIGHT: 391.4596
SMILES: COC1=C(C=C2C(=C1)CCN=C2CC3=CC4=CC(=C(C=C4C=C3)OC)OC)OC
Structure:

CAS RN: 93257-70-6
CAS Name: 6-methoxy-2-oxo-1H-quinoline-4-carboxylic acid ethyl ester
OPENEYE Name: ethyl 6-methoxy-2-oxo-1H-quinoline-4-carboxylate
IUPAC Name: ethyl 6-methoxy-2-oxo-1H-quinoline-4-carboxylate
SYSTEMATIC NAME: ethyl 6-methoxy-2-oxidanylidene-1H-quinoline-4-carboxylate
MOLECULAR FORMULA: C13H13NO4
MOLECULAR WEIGHT: 247.24662
SMILES: CCOC(=O)C1=CC(=O)NC2=C1C=C(C=C2)OC
Structure:

CAS RN: 59290-81-2
CAS Name: 2-methyl-5-nitro-3-pyridinecarboxylic acid
OPENEYE Name: 2-methyl-5-nitro-pyridine-3-carboxylic acid
IUPAC Name: 2-methyl-5-nitropyridine-3-carboxylic acid
SYSTEMATIC NAME: 2-methyl-5-nitro-pyridine-3-carboxylic acid
MOLECULAR FORMULA: C7H6N2O4
MOLECULAR WEIGHT: 182.13354
SMILES: CC1=NC=C(C=C1C(=O)O)[N+](=O)[O-]
Structure:

CAS RN: 51984-71-5
CAS Name: 2-methyl-5-nitro-3-pyridinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 2-methyl-5-nitro-pyridine-3-carboxylate
IUPAC Name: ethyl 2-methyl-5-nitropyridine-3-carboxylate
SYSTEMATIC NAME: ethyl 2-methyl-5-nitro-pyridine-3-carboxylate
MOLECULAR FORMULA: C9H10N2O4
MOLECULAR WEIGHT: 210.1867
SMILES: CCOC(=O)C1=CC(=CN=C1C)[N+](=O)[O-]
Structure:

CAS RN: 52315-92-1
CAS Name: 2-methyl-5-nitro-3-pyridinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 2-methyl-5-nitro-pyridine-3-carboxylate
IUPAC Name: ethyl 2-methyl-5-nitropyridine-3-carboxylate
SYSTEMATIC NAME: ethyl 2-methyl-5-nitro-pyridine-3-carboxylate
MOLECULAR FORMULA: C9H10N2O4
MOLECULAR WEIGHT: 210.1867
SMILES: CCOC(=O)C1=CC(=CN=C1C)[N+](=O)[O-]
Structure:

CAS RN: 4420-12-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H14O4
MOLECULAR WEIGHT: 198.21576
SMILES: CC1(OC2CC3CC(C2O1)OC3=O)C
Structure:

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