Saturday, July 23, 2011

http://ChemLookup.com Compounds




CAS RN: 909036-46-0
CAS Name: 2-chloro-3-iodo-4-pyridinamine
OPENEYE Name: 2-chloro-3-iodo-pyridin-4-amine
IUPAC Name: 2-chloro-3-iodopyridin-4-amine
SYSTEMATIC NAME: 2-chloranyl-3-iodanyl-pyridin-4-amine
MOLECULAR FORMULA: C5H4ClIN2
MOLECULAR WEIGHT: 254.45613
SMILES: C1=CN=C(C(=C1N)I)Cl
Structure:

CAS RN: 851484-95-2
CAS Name: 2-chloro-5-fluoro-3-pyridinecarboxaldehyde
OPENEYE Name: 2-chloro-5-fluoro-pyridine-3-carbaldehyde
IUPAC Name: 2-chloro-5-fluoropyridine-3-carbaldehyde
SYSTEMATIC NAME: 2-chloranyl-5-fluoranyl-pyridine-3-carbaldehyde
MOLECULAR FORMULA: C6H3ClFNO
MOLECULAR WEIGHT: 159.545523
SMILES: C1=C(C(=NC=C1F)Cl)C=O
Structure:

CAS RN: 884494-33-1
CAS Name: 2-chloro-5-fluoro-3-iodopyridine
OPENEYE Name: 2-chloro-5-fluoro-3-iodo-pyridine
IUPAC Name: 2-chloro-5-fluoro-3-iodopyridine
SYSTEMATIC NAME: 2-chloranyl-5-fluoranyl-3-iodanyl-pyridine
MOLECULAR FORMULA: C5H2ClFIN
MOLECULAR WEIGHT: 257.431953
SMILES: C1=C(C=NC(=C1I)Cl)F
Structure:

CAS RN: 709652-82-4
CAS Name: 2-amino-5-bromo-3-pyridinecarbonitrile
OPENEYE Name: 2-amino-5-bromo-pyridine-3-carbonitrile
IUPAC Name: 2-amino-5-bromopyridine-3-carbonitrile
SYSTEMATIC NAME: 2-azanyl-5-bromanyl-pyridine-3-carbonitrile
MOLECULAR FORMULA: C6H4BrN3
MOLECULAR WEIGHT: 198.02006
SMILES: C1=C(C(=NC=C1Br)N)C#N
Structure:

CAS RN: 873302-39-7
CAS Name: N-(5-bromo-3-pyridinyl)-2,2-dimethylpropanamide
OPENEYE Name: N-(5-bromo-3-pyridyl)-2,2-dimethyl-propanamide
IUPAC Name: N-(5-bromopyridin-3-yl)-2,2-dimethylpropanamide
SYSTEMATIC NAME: N-(5-bromanylpyridin-3-yl)-2,2-dimethyl-propanamide
MOLECULAR FORMULA: C10H13BrN2O
MOLECULAR WEIGHT: 257.12702
SMILES: CC(C)(C)C(=O)NC1=CC(=CN=C1)Br
Structure:

CAS RN: 25391-66-6
CAS Name: 5-iodo-3-pyridinamine
OPENEYE Name: 5-iodopyridin-3-amine
IUPAC Name: 5-iodopyridin-3-amine
SYSTEMATIC NAME: 5-iodanylpyridin-3-amine
MOLECULAR FORMULA: C5H5IN2
MOLECULAR WEIGHT: 220.01107
SMILES: C1=C(C=NC=C1I)N
Structure:

CAS RN: 873302-38-6
CAS Name: N-(5-iodo-3-pyridinyl)-2,2-dimethylpropanamide
OPENEYE Name: N-(5-iodo-3-pyridyl)-2,2-dimethyl-propanamide
IUPAC Name: N-(5-iodopyridin-3-yl)-2,2-dimethylpropanamide
SYSTEMATIC NAME: N-(5-iodanylpyridin-3-yl)-2,2-dimethyl-propanamide
MOLECULAR FORMULA: C10H13IN2O
MOLECULAR WEIGHT: 304.12749
SMILES: CC(C)(C)C(=O)NC1=CC(=CN=C1)I
Structure:

CAS RN: 873302-37-5
CAS Name: 3-(5-bromo-3-pyridinyl)-2-propyn-1-ol
OPENEYE Name: 3-(5-bromo-3-pyridyl)prop-2-yn-1-ol
IUPAC Name: 3-(5-bromopyridin-3-yl)prop-2-yn-1-ol
SYSTEMATIC NAME: 3-(5-bromanylpyridin-3-yl)prop-2-yn-1-ol
MOLECULAR FORMULA: C8H6BrNO
MOLECULAR WEIGHT: 212.04334
SMILES: C1=C(C=NC=C1Br)C#CCO
Structure:

CAS RN: 873302-36-4
CAS Name: 3-iodo-5-methoxypyridine
OPENEYE Name: 3-iodo-5-methoxy-pyridine
IUPAC Name: 3-iodo-5-methoxypyridine
SYSTEMATIC NAME: 3-iodanyl-5-methoxy-pyridine
MOLECULAR FORMULA: C6H6INO
MOLECULAR WEIGHT: 235.02241
SMILES: COC1=CC(=CN=C1)I
Structure:

CAS RN: 77332-90-2
CAS Name: 3-chloro-5-iodopyridine
OPENEYE Name: 3-chloro-5-iodo-pyridine
IUPAC Name: 3-chloro-5-iodopyridine
SYSTEMATIC NAME: 3-chloranyl-5-iodanyl-pyridine
MOLECULAR FORMULA: C5H3ClIN
MOLECULAR WEIGHT: 239.44149
SMILES: C1=C(C=NC=C1I)Cl
Structure:

CAS RN: 869735-25-1
CAS Name: N-(2-iodo-4-pyridinyl)carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-(2-iodo-4-pyridyl)carbamate
IUPAC Name: tert-butyl N-(2-iodopyridin-4-yl)carbamate
SYSTEMATIC NAME: tert-butyl N-(2-iodanylpyridin-4-yl)carbamate
MOLECULAR FORMULA: C10H13IN2O2
MOLECULAR WEIGHT: 320.12689
SMILES: CC(C)(C)OC(=O)NC1=CC(=NC=C1)I
Structure:

CAS RN: 849353-31-7
CAS Name: N-(2-methoxy-4-pyridinyl)carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-(2-methoxy-4-pyridyl)carbamate
IUPAC Name: tert-butyl N-(2-methoxypyridin-4-yl)carbamate
SYSTEMATIC NAME: tert-butyl N-(2-methoxypyridin-4-yl)carbamate
MOLECULAR FORMULA: C11H16N2O3
MOLECULAR WEIGHT: 224.25634
SMILES: CC(C)(C)OC(=O)NC1=CC(=NC=C1)OC
Structure:

CAS RN: 855784-42-8
CAS Name: 6-methoxy-2-pyridinecarbohydrazide
OPENEYE Name: 6-methoxypyridine-2-carbohydrazide
IUPAC Name: 6-methoxypyridine-2-carbohydrazide
SYSTEMATIC NAME: 6-methoxypyridine-2-carbohydrazide
MOLECULAR FORMULA: C7H9N3O2
MOLECULAR WEIGHT: 167.16526
SMILES: COC1=CC=CC(=N1)C(=O)NN
Structure:

CAS RN: 855784-40-6
CAS Name: N-(6-methoxy-2-pyridinyl)carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-(6-methoxy-2-pyridyl)carbamate
IUPAC Name: tert-butyl N-(6-methoxypyridin-2-yl)carbamate
SYSTEMATIC NAME: tert-butyl N-(6-methoxypyridin-2-yl)carbamate
MOLECULAR FORMULA: C11H16N2O3
MOLECULAR WEIGHT: 224.25634
SMILES: CC(C)(C)OC(=O)NC1=NC(=CC=C1)OC
Structure:

CAS RN: 851102-44-8
CAS Name: N-(6-iodo-2-pyridinyl)-2,2-dimethylpropanamide
OPENEYE Name: N-(6-iodo-2-pyridyl)-2,2-dimethyl-propanamide
IUPAC Name: N-(6-iodopyridin-2-yl)-2,2-dimethylpropanamide
SYSTEMATIC NAME: N-(6-iodanylpyridin-2-yl)-2,2-dimethyl-propanamide
MOLECULAR FORMULA: C10H13IN2O
MOLECULAR WEIGHT: 304.12749
SMILES: CC(C)(C)C(=O)NC1=NC(=CC=C1)I
Structure:

CAS RN: 851102-43-7
CAS Name: 6-iodo-2-pyridinecarbohydrazide
OPENEYE Name: 6-iodopyridine-2-carbohydrazide
IUPAC Name: 6-iodopyridine-2-carbohydrazide
SYSTEMATIC NAME: 6-iodanylpyridine-2-carbohydrazide
MOLECULAR FORMULA: C6H6IN3O
MOLECULAR WEIGHT: 263.03581
SMILES: C1=CC(=NC(=C1)I)C(=O)NN
Structure:

CAS RN: 851102-42-6
CAS Name: 6-iodo-2-pyridinecarboxamide
OPENEYE Name: 6-iodopyridine-2-carboxamide
IUPAC Name: 6-iodopyridine-2-carboxamide
SYSTEMATIC NAME: 6-iodanylpyridine-2-carboxamide
MOLECULAR FORMULA: C6H5IN2O
MOLECULAR WEIGHT: 248.02117
SMILES: C1=CC(=NC(=C1)I)C(=O)N
Structure:

CAS RN: 851102-41-5
CAS Name: (6-iodo-2-pyridinyl)methanol
OPENEYE Name: (6-iodo-2-pyridyl)methanol
IUPAC Name: (6-iodopyridin-2-yl)methanol
SYSTEMATIC NAME: (6-iodanylpyridin-2-yl)methanol
MOLECULAR FORMULA: C6H6INO
MOLECULAR WEIGHT: 235.02241
SMILES: C1=CC(=NC(=C1)I)CO
Structure:

CAS RN: 849830-17-7
CAS Name: N-(6-iodo-2-pyridinyl)carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-(6-iodo-2-pyridyl)carbamate
IUPAC Name: tert-butyl N-(6-iodopyridin-2-yl)carbamate
SYSTEMATIC NAME: tert-butyl N-(6-iodanylpyridin-2-yl)carbamate
MOLECULAR FORMULA: C10H13IN2O2
MOLECULAR WEIGHT: 320.12689
SMILES: CC(C)(C)OC(=O)NC1=NC(=CC=C1)I
Structure:

CAS RN: 773087-36-8
CAS Name: N-[3-(1,3-dioxolan-2-yl)-4-pyridinyl]-2,2-dimethylpropanamide
OPENEYE Name: N-[3-(1,3-dioxolan-2-yl)-4-pyridyl]-2,2-dimethyl-propanamide
IUPAC Name: N-[3-(1,3-dioxolan-2-yl)pyridin-4-yl]-2,2-dimethylpropanamide
SYSTEMATIC NAME: N-[3-(1,3-dioxolan-2-yl)pyridin-4-yl]-2,2-dimethyl-propanamide
MOLECULAR FORMULA: C13H18N2O3
MOLECULAR WEIGHT: 250.29362
SMILES: CC(C)(C)C(=O)NC1=C(C=NC=C1)C2OCCO2
Structure:

CAS RN: 869735-24-0
CAS Name: N-[4-(1,3-dioxolan-2-yl)-3-pyridinyl]-2,2-dimethylpropanamide
OPENEYE Name: N-[4-(1,3-dioxolan-2-yl)-3-pyridyl]-2,2-dimethyl-propanamide
IUPAC Name: N-[4-(1,3-dioxolan-2-yl)pyridin-3-yl]-2,2-dimethylpropanamide
SYSTEMATIC NAME: N-[4-(1,3-dioxolan-2-yl)pyridin-3-yl]-2,2-dimethyl-propanamide
MOLECULAR FORMULA: C13H18N2O3
MOLECULAR WEIGHT: 250.29362
SMILES: CC(C)(C)C(=O)NC1=C(C=CN=C1)C2OCCO2
Structure:

CAS RN: 861708-66-9
CAS Name: 2,4-dichloro-5-thiazolecarboxylic acid methyl ester
OPENEYE Name: methyl 2,4-dichlorothiazole-5-carboxylate
IUPAC Name: methyl 2,4-dichloro-1,3-thiazole-5-carboxylate
SYSTEMATIC NAME: methyl 2,4-bis(chloranyl)-1,3-thiazole-5-carboxylate
MOLECULAR FORMULA: C5H3Cl2NO2S
MOLECULAR WEIGHT: 212.05382
SMILES: COC(=O)C1=C(N=C(S1)Cl)Cl
Structure:

CAS RN: 206997-15-1
CAS Name: 2-amino-5-bromo-3-pyridinecarboxaldehyde
OPENEYE Name: 2-amino-5-bromo-pyridine-3-carbaldehyde
IUPAC Name: 2-amino-5-bromopyridine-3-carbaldehyde
SYSTEMATIC NAME: 2-azanyl-5-bromanyl-pyridine-3-carbaldehyde
MOLECULAR FORMULA: C6H5BrN2O
MOLECULAR WEIGHT: 201.0207
SMILES: C1=C(C(=NC=C1Br)N)C=O
Structure:

CAS RN: 750-90-3
CAS Name: (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxy-4-quinolinyl)methanol; 2-hydroxybenzoic acid
OPENEYE Name: 2-hydroxybenzoic acid; (6-methoxy-4-quinolyl)-(5-vinylquinuclidin-2-yl)methanol
IUPAC Name: (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanol; 2-hydroxybenzoic acid
SYSTEMATIC NAME: (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanol; 2-oxidanylbenzoic acid
MOLECULAR FORMULA: C27H30N2O5
MOLECULAR WEIGHT: 462.5375
SMILES: COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O.C1=CC=C(C(=C1)C(=O)O)O
Structure:

CAS RN: 148223-47-6
CAS Name: 2-(4-methoxy-3-phenylmethoxyphenyl)ethanamine hydrochloride
OPENEYE Name: 2-(3-benzyloxy-4-methoxy-phenyl)ethanamine hydrochloride
IUPAC Name: 2-(4-methoxy-3-phenylmethoxyphenyl)ethanamine hydrochloride
SYSTEMATIC NAME: 2-(4-methoxy-3-phenylmethoxy-phenyl)ethanamine hydrochloride
MOLECULAR FORMULA: C16H20ClNO2
MOLECULAR WEIGHT: 293.7885
SMILES: COC1=C(C=C(C=C1)CCN)OCC2=CC=CC=C2.Cl
Structure:

CAS RN: 675198-19-3
CAS Name: [4-(3-methoxypropoxy)-3-methyl-2-pyridinyl]methanol hydrochloride
OPENEYE Name: [4-(3-methoxypropoxy)-3-methyl-2-pyridyl]methanol hydrochloride
IUPAC Name: [4-(3-methoxypropoxy)-3-methylpyridin-2-yl]methanol hydrochloride
SYSTEMATIC NAME: [4-(3-methoxypropoxy)-3-methyl-pyridin-2-yl]methanol hydrochloride
MOLECULAR FORMULA: C11H18ClNO3
MOLECULAR WEIGHT: 247.71852
SMILES: CC1=C(C=CN=C1CO)OCCCOC.Cl
Structure:

CAS RN: 53587-11-4
CAS Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid (phenylmethyl) ester; 4-methylbenzenesulfonic acid
OPENEYE Name: benzyl 2-amino-3-(4-hydroxyphenyl)propanoate; 4-methylbenzenesulfonic acid
IUPAC Name: benzyl 2-amino-3-(4-hydroxyphenyl)propanoate; 4-methylbenzenesulfonic acid
SYSTEMATIC NAME: 4-methylbenzenesulfonic acid; (phenylmethyl) 2-azanyl-3-(4-hydroxyphenyl)propanoate
MOLECULAR FORMULA: C23H25NO6S
MOLECULAR WEIGHT: 443.5127
SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)COC(=O)C(CC2=CC=C(C=C2)O)N
Structure:

CAS RN: 125756-95-8
CAS Name: 4-bromo-3-ethoxyaniline hydrochloride
OPENEYE Name: 4-bromo-3-ethoxy-aniline hydrochloride
IUPAC Name: 4-bromo-3-ethoxyaniline hydrochloride
SYSTEMATIC NAME: 4-bromanyl-3-ethoxy-aniline hydrochloride
MOLECULAR FORMULA: C8H11BrClNO
MOLECULAR WEIGHT: 252.53604
SMILES: CCOC1=C(C=CC(=C1)N)Br.Cl
Structure:

CAS RN: 2732-80-1
CAS Name: 2-bromo-1-chloro-4-methoxybenzene
OPENEYE Name: 2-bromo-1-chloro-4-methoxy-benzene
IUPAC Name: 2-bromo-1-chloro-4-methoxybenzene
SYSTEMATIC NAME: 2-bromanyl-1-chloranyl-4-methoxy-benzene
MOLECULAR FORMULA: C7H6BrClO
MOLECULAR WEIGHT: 221.47894
SMILES: COC1=CC(=C(C=C1)Cl)Br
Structure:

CAS RN: 6151-40-2
CAS Name: (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxy-4-quinolinyl)methanol hydrate hydrochloride
OPENEYE Name: (6-methoxy-4-quinolyl)-(5-vinylquinuclidin-2-yl)methanol hydrate hydrochloride
IUPAC Name: (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanol hydrate hydrochloride
SYSTEMATIC NAME: (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanol hydrate hydrochloride
MOLECULAR FORMULA: C20H27ClN2O3
MOLECULAR WEIGHT: 378.89298
SMILES: COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O.O.Cl
Structure:

CAS RN: 84145-02-8
CAS Name: 2,6-diamino-7,9-dihydropurin-8-one; sulfuric acid
OPENEYE Name: 2,6-diamino-7,9-dihydropurin-8-one; sulfuric acid
IUPAC Name: 2,6-diamino-7,9-dihydropurin-8-one; sulfuric acid
SYSTEMATIC NAME: 2,6-bis(azanyl)-7,9-dihydropurin-8-one; sulfuric acid
MOLECULAR FORMULA: C10H14N12O6S
MOLECULAR WEIGHT: 430.35996
SMILES: C12=C(NC(=O)N1)N=C(N=C2N)N.C12=C(NC(=O)N1)N=C(N=C2N)N.OS(=O)(=O)O
Structure:

CAS RN: 80997-83-7
CAS Name: benzoic acid; 2-(methylamino)-1-phenylethanol
OPENEYE Name: benzoic acid; 2-(methylamino)-1-phenyl-ethanol
IUPAC Name: benzoic acid; 2-(methylamino)-1-phenylethanol
SYSTEMATIC NAME: benzoic acid; 2-(methylamino)-1-phenyl-ethanol
MOLECULAR FORMULA: C16H19NO3
MOLECULAR WEIGHT: 273.32696
SMILES: CNCC(C1=CC=CC=C1)O.C1=CC=C(C=C1)C(=O)O
Structure:

CAS RN: 902836-97-9
CAS Name: 4-[2-(methylaminomethyl)phenoxy]benzenesulfonamide
OPENEYE Name: 4-[2-(methylaminomethyl)phenoxy]benzenesulfonamide
IUPAC Name: 4-[2-(methylaminomethyl)phenoxy]benzenesulfonamide
SYSTEMATIC NAME: 4-[2-(methylaminomethyl)phenoxy]benzenesulfonamide
MOLECULAR FORMULA: C14H16N2O3S
MOLECULAR WEIGHT: 292.35344
SMILES: CNCC1=CC=CC=C1OC2=CC=C(C=C2)S(=O)(=O)N
Structure:

CAS RN: 871839-91-7
CAS Name: 2-propan-2-yloxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
OPENEYE Name: 2-isopropoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
IUPAC Name: 2-propan-2-yloxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
SYSTEMATIC NAME: 2-propan-2-yloxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
MOLECULAR FORMULA: C14H22BNO3
MOLECULAR WEIGHT: 263.14038
SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)OC(C)C
Structure:

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