Sunday, July 31, 2011

http://ChemLookup.com Compounds




CAS RN: 932-24-1
CAS Name: (2S,3R)-1,1,2-trimethyl-3-propan-2-ylaziridin-1-ium iodide
OPENEYE Name: (2R,3S)-2-isopropyl-1,1,3-trimethyl-aziridin-1-ium iodide
IUPAC Name: (2S,3R)-1,1,2-trimethyl-3-propan-2-ylaziridin-1-ium iodide
SYSTEMATIC NAME: (2S,3R)-1,1,2-trimethyl-3-propan-2-yl-aziridin-1-ium iodide
MOLECULAR FORMULA: C8H18IN
MOLECULAR WEIGHT: 255.13969
SMILES: C[C@H]1[C@H]([N+]1(C)C)C(C)C.[I-]
Structure:

CAS RN: 43177-74-8
CAS Name: (2R,3R)-1,1,2,3-tetramethylaziridin-1-ium hydroiodide
OPENEYE Name: (2R,3R)-1,1,2,3-tetramethylaziridin-1-ium hydroiodide
IUPAC Name: (2R,3R)-1,1,2,3-tetramethylaziridin-1-ium hydroiodide
SYSTEMATIC NAME: (2R,3R)-1,1,2,3-tetramethylaziridin-1-ium hydroiodide
MOLECULAR FORMULA: C6H15IN+
MOLECULAR WEIGHT: 228.09447
SMILES: C[C@@H]1[C@H]([N+]1(C)C)C.I
Structure:

CAS RN: 13658-91-8
CAS Name: N-[2-(diethylamino)ethyl]-N-phenylcarbamic acid phenyl ester hydrochloride
OPENEYE Name: phenyl N-[2-(diethylamino)ethyl]-N-phenyl-carbamate hydrochloride
IUPAC Name: phenyl N-[2-(diethylamino)ethyl]-N-phenylcarbamate hydrochloride
SYSTEMATIC NAME: phenyl N-[2-(diethylamino)ethyl]-N-phenyl-carbamate hydrochloride
MOLECULAR FORMULA: C19H25ClN2O2
MOLECULAR WEIGHT: 348.867
SMILES: CCN(CC)CCN(C1=CC=CC=C1)C(=O)OC2=CC=CC=C2.Cl
Structure:

CAS RN: 27466-69-9
CAS Name: 3-[4-[bis(2-chloroethyl)amino]phenyl]-2-[(4-methyl-1-piperazinyl)-oxomethyl]-2-propenenitrile hydrochloride
OPENEYE Name: 3-[4-[bis(2-chloroethyl)amino]phenyl]-2-(4-methylpiperazine-1-carbonyl)prop-2-enenitrile hydrochloride
IUPAC Name: 3-[4-[bis(2-chloroethyl)amino]phenyl]-2-(4-methylpiperazine-1-carbonyl)prop-2-enenitrile hydrochloride
SYSTEMATIC NAME: 3-[4-[bis(2-chloroethyl)amino]phenyl]-2-(4-methylpiperazin-1-yl)carbonyl-prop-2-enenitrile hydrochloride
MOLECULAR FORMULA: C19H25Cl3N4O
MOLECULAR WEIGHT: 431.787
SMILES: CN1CCN(CC1)C(=O)C(=CC2=CC=C(C=C2)N(CCCl)CCCl)C#N.Cl
Structure:

CAS RN: 4840-37-3
CAS Name: 2-amino-N-(2-chloroethyl)acetamide hydrochloride
OPENEYE Name: 2-amino-N-(2-chloroethyl)acetamide hydrochloride
IUPAC Name: 2-amino-N-(2-chloroethyl)acetamide hydrochloride
SYSTEMATIC NAME: 2-azanyl-N-(2-chloroethyl)ethanamide hydrochloride
MOLECULAR FORMULA: C4H10Cl2N2O
MOLECULAR WEIGHT: 173.041
SMILES: C(CCl)NC(=O)CN.Cl
Structure:

CAS RN: 91159-31-8
CAS Name: 2-amino-N-(2-chloroethyl)propanamide hydrochloride
OPENEYE Name: 2-amino-N-(2-chloroethyl)propanamide hydrochloride
IUPAC Name: 2-amino-N-(2-chloroethyl)propanamide hydrochloride
SYSTEMATIC NAME: 2-azanyl-N-(2-chloroethyl)propanamide hydrochloride
MOLECULAR FORMULA: C5H12Cl2N2O
MOLECULAR WEIGHT: 187.06758
SMILES: CC(C(=O)NCCCl)N.Cl
Structure:

CAS RN: 18472-09-8
CAS Name: 7-amino-5-bromo-8-quinolinol hydrochloride
OPENEYE Name: 7-amino-5-bromo-quinolin-8-ol hydrochloride
IUPAC Name: 7-amino-5-bromoquinolin-8-ol hydrochloride
SYSTEMATIC NAME: 7-azanyl-5-bromanyl-quinolin-8-ol hydrochloride
MOLECULAR FORMULA: C9H8BrClN2O
MOLECULAR WEIGHT: 275.52962
SMILES: C1=CC2=C(C=C(C(=C2N=C1)O)N)Br.Cl
Structure:

CAS RN: 50312-97-5
CAS Name: [5-(dimethylamino)-1,2,4-dithiazol-3-ylidene]-dimethylammonium iodide
OPENEYE Name: [5-(dimethylamino)-1,2,4-dithiazol-3-ylidene]-dimethyl-ammonium iodide
IUPAC Name: [5-(dimethylamino)-1,2,4-dithiazol-3-ylidene]-dimethylazanium iodide
SYSTEMATIC NAME: [5-(dimethylamino)-1,2,4-dithiazol-3-ylidene]-dimethyl-azanium iodide
MOLECULAR FORMULA: C6H12IN3S2
MOLECULAR WEIGHT: 317.21405
SMILES: CN(C)C1=NC(=[N+](C)C)SS1.[I-]
Structure:

CAS RN: 54901-53-0
CAS Name: 2-(2-amino-4-methyl-5-thiazolyl)ethanol chloride
OPENEYE Name: 2-(2-amino-4-methyl-thiazol-5-yl)ethanol chloride
IUPAC Name: 2-(2-amino-4-methyl-1,3-thiazol-5-yl)ethanol chloride
SYSTEMATIC NAME: 2-(2-azanyl-4-methyl-1,3-thiazol-5-yl)ethanol chloride
MOLECULAR FORMULA: C6H10ClN2OS-
MOLECULAR WEIGHT: 193.6744
SMILES: CC1=C(SC(=N1)N)CCO.[Cl-]
Structure:

CAS RN: 54104-37-9
CAS Name: 2-(3-chloropropyl)-1H-benzimidazole hydrochloride
OPENEYE Name: 2-(3-chloropropyl)-1H-benzimidazole hydrochloride
IUPAC Name: 2-(3-chloropropyl)-1H-benzimidazole hydrochloride
SYSTEMATIC NAME: 2-(3-chloranylpropyl)-1H-benzimidazole hydrochloride
MOLECULAR FORMULA: C10H12Cl2N2
MOLECULAR WEIGHT: 231.12168
SMILES: C1=CC=C2C(=C1)NC(=N2)CCCCl.Cl
Structure:

CAS RN: 67740-85-6
CAS Name: 2-[(Z)-[(2E)-1-[4-[2-[4-[(1Z,2E)-1,2-bis(diaminomethylidenehydrazinylidene)ethyl]phenyl]ethyl]phenyl]-2-(diaminomethylidenehydrazinylidene)ethylidene]amino]guanidine chloride
OPENEYE Name: 2-[(Z)-[(2E)-2-(diaminomethylenehydrazono)-1-[4-[2-[4-[(Z)-C-[(E)-(diaminomethylenehydrazono)methyl]-N-guanidino-carbonimidoyl]phenyl]ethyl]phenyl]ethylidene]amino]guanidine chloride
IUPAC Name: 2-[(Z)-[(2E)-1-[4-[2-[4-[(Z)-N-(diaminomethylideneamino)-C-[(E)-(diaminomethylidenehydrazinylidene)methyl]carbonimidoyl]phenyl]ethyl]phenyl]-2-(diaminomethylidenehydrazinylidene)ethylidene]amino]guanidine chloride
SYSTEMATIC NAME: 2-[(Z)-[(2E)-1-[4-[2-[4-[(Z)-N-[bis(azanyl)methylideneamino]-C-[(E)-[bis(azanyl)methylidenehydrazinylidene]methyl]carbonimidoyl]phenyl]ethyl]phenyl]-2-[bis(azanyl)methylidenehydrazinylidene]ethylidene]amino]guanidine chloride
MOLECULAR FORMULA: C22H30ClN16-
MOLECULAR WEIGHT: 554.0338
SMILES: C1=CC(=CC=C1CCC2=CC=C(C=C2)/C(=N/N=C(N)N)/C=N/N=C(N)N)/C(=N/N=C(N)N)/C=N/N=C(N)N.[Cl-]
Structure:

CAS RN: 51874-27-2
CAS Name: 5-bromo-1-pentanamine hydrobromide
OPENEYE Name: 5-bromopentan-1-amine hydrobromide
IUPAC Name: 5-bromopentan-1-amine hydrobromide
SYSTEMATIC NAME: 5-bromanylpentan-1-amine hydrobromide
MOLECULAR FORMULA: C5H13Br2N
MOLECULAR WEIGHT: 246.97142
SMILES: C(CCN)CCBr.Br
Structure:

CAS RN: 24566-81-2
CAS Name: 4-bromo-1-butanamine hydrobromide
OPENEYE Name: 4-bromobutan-1-amine hydrobromide
IUPAC Name: 4-bromobutan-1-amine hydrobromide
SYSTEMATIC NAME: 4-bromanylbutan-1-amine hydrobromide
MOLECULAR FORMULA: C4H11Br2N
MOLECULAR WEIGHT: 232.94484
SMILES: C(CCBr)CN.Br
Structure:

CAS RN: 17027-69-9
CAS Name: 2-(4-phenylphenyl)ethanamine chloride
OPENEYE Name: 2-(4-phenylphenyl)ethanamine chloride
IUPAC Name: 2-(4-phenylphenyl)ethanamine chloride
SYSTEMATIC NAME: 2-(4-phenylphenyl)ethanamine chloride
MOLECULAR FORMULA: C14H15ClN-
MOLECULAR WEIGHT: 232.7286
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)CCN.[Cl-]
Structure:

CAS RN: 3166-29-8
CAS Name: 3-methylthiazolo[3,2-a]pyridin-4-ium perchlorate
OPENEYE Name: 3-methylthiazolo[3,2-a]pyridin-4-ium perchlorate
IUPAC Name: 3-methyl-[1,3]thiazolo[3,2-a]pyridin-4-ium perchlorate
SYSTEMATIC NAME: 3-methyl-[1,3]thiazolo[3,2-a]pyridin-4-ium perchlorate
MOLECULAR FORMULA: C8H8ClNO4S
MOLECULAR WEIGHT: 249.67142
SMILES: CC1=CSC2=CC=CC=[N+]12.[O-]Cl(=O)(=O)=O
Structure:

CAS RN: 14883-58-0
CAS Name: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; dichlorocobalt
OPENEYE Name: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; dichlorocobalt
IUPAC Name: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; dichlorocobalt
SYSTEMATIC NAME: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; bis(chloranyl)cobalt
MOLECULAR FORMULA: C6H14Cl2CoN4-4
MOLECULAR WEIGHT: 272.04136
SMILES: C(C[N-]CC[N-]CC[NH-])[NH-].Cl[Co]Cl
Structure:

CAS RN: 15555-97-2
CAS Name: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; dichlorocobalt
OPENEYE Name: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; dichlorocobalt
IUPAC Name: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; dichlorocobalt
SYSTEMATIC NAME: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; bis(chloranyl)cobalt
MOLECULAR FORMULA: C6H14Cl2CoN4-4
MOLECULAR WEIGHT: 272.04136
SMILES: C(C[N-]CC[N-]CC[NH-])[NH-].Cl[Co]Cl
Structure:

CAS RN: 30482-52-1
CAS Name: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; dichlorocobalt
OPENEYE Name: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; dichlorocobalt
IUPAC Name: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; dichlorocobalt
SYSTEMATIC NAME: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; bis(chloranyl)cobalt
MOLECULAR FORMULA: C6H14Cl2CoN4-4
MOLECULAR WEIGHT: 272.04136
SMILES: C(C[N-]CC[N-]CC[NH-])[NH-].Cl[Co]Cl
Structure:

CAS RN: 6168-88-3
CAS Name: 2-[(2R,6S)-1-methyl-6-phenacyl-2-piperidinyl]-1-phenylethanone chloride
OPENEYE Name: 2-[(2R,6S)-1-methyl-6-phenacyl-2-piperidyl]-1-phenyl-ethanone chloride
IUPAC Name: 2-[(2R,6S)-1-methyl-6-phenacylpiperidin-2-yl]-1-phenylethanone chloride
SYSTEMATIC NAME: 2-[(2R,6S)-1-methyl-6-phenacyl-piperidin-2-yl]-1-phenyl-ethanone chloride
MOLECULAR FORMULA: C22H25ClNO2-
MOLECULAR WEIGHT: 370.8924
SMILES: CN1[C@H](CCC[C@H]1CC(=O)C2=CC=CC=C2)CC(=O)C3=CC=CC=C3.[Cl-]
Structure:

CAS RN: 363-11-1
CAS Name: 7-methoxy-1-methyl-3,4-dihydro-2H-pyrido[3,4-b]indole chloride
OPENEYE Name: 7-methoxy-1-methyl-3,4-dihydro-2H-pyrido[3,4-b]indole chloride
IUPAC Name: 7-methoxy-1-methyl-3,4-dihydro-2H-pyrido[3,4-b]indole chloride
SYSTEMATIC NAME: 7-methoxy-1-methyl-3,4-dihydro-2H-pyrido[3,4-b]indole chloride
MOLECULAR FORMULA: C13H14ClN2O-
MOLECULAR WEIGHT: 249.71606
SMILES: CC1=C2C(=C3C=CC(=CC3=N2)OC)CCN1.[Cl-]
Structure:

CAS RN: 53823-72-6
CAS Name: barium; 3-hydroxy-2-phosphonooxypropanoic acid
OPENEYE Name: barium; 3-hydroxy-2-phosphonooxy-propanoic acid
IUPAC Name: barium; 3-hydroxy-2-phosphonooxypropanoic acid
SYSTEMATIC NAME: barium; 3-oxidanyl-2-phosphonooxy-propanoic acid
MOLECULAR FORMULA: C3H7BaO7P
MOLECULAR WEIGHT: 323.384241
SMILES: C(C(C(=O)O)OP(=O)(O)O)O.[Ba]
Structure:

CAS RN: 923-14-8
CAS Name: barium; 2-phosphonooxy-2-propenoic acid; silver
OPENEYE Name: barium; 2-phosphonooxyprop-2-enoic acid; silver
IUPAC Name: barium; 2-phosphonooxyprop-2-enoic acid; silver
SYSTEMATIC NAME: barium; 2-phosphonooxyprop-2-enoic acid; silver
MOLECULAR FORMULA: C3H5AgBaO6P
MOLECULAR WEIGHT: 413.237161
SMILES: C=C(C(=O)O)OP(=O)(O)O.[Ag].[Ba]
Structure:

CAS RN: 84473-60-9
CAS Name: 4-methoxy-1-naphthalenesulfonic acid; sodium
OPENEYE Name: 4-methoxynaphthalene-1-sulfonic acid; sodium
IUPAC Name: 4-methoxynaphthalene-1-sulfonic acid; sodium
SYSTEMATIC NAME: 4-methoxynaphthalene-1-sulfonic acid; sodium
MOLECULAR FORMULA: C11H10NaO4S
MOLECULAR WEIGHT: 261.24947
SMILES: COC1=CC=C(C2=CC=CC=C21)S(=O)(=O)O.[Na]
Structure:

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