Friday, May 25, 2012

http://ChemLookup.com Compounds




CAS RN: 6345-96-6
CAS Name: 2-mercapto-2-methylpropanamide
OPENEYE Name: 2-methyl-2-sulfanyl-propanamide
IUPAC Name: 2-methyl-2-sulfanylpropanamide
SYSTEMATIC NAME: 2-methyl-2-sulfanyl-propanamide
MOLECULAR FORMULA: C4H9NOS
MOLECULAR WEIGHT: 119.18536
SMILES: CC(C)(C(=O)N)S
Structure:

CAS RN: 6329-60-8
CAS Name: 4-prop-2-ynylmorpholine
OPENEYE Name: 4-prop-2-ynylmorpholine
IUPAC Name: 4-prop-2-ynylmorpholine
SYSTEMATIC NAME: 4-prop-2-ynylmorpholine
MOLECULAR FORMULA: C7H11NO
MOLECULAR WEIGHT: 125.16834
SMILES: C#CCN1CCOCC1
Structure:

CAS RN: 6317-79-9
CAS Name: 3-(4-morpholinyl)-1-[4-(phenylthio)phenyl]-1-propanol
OPENEYE Name: 3-morpholino-1-(4-phenylsulfanylphenyl)propan-1-ol
IUPAC Name: 3-morpholin-4-yl-1-(4-phenylsulfanylphenyl)propan-1-ol
SYSTEMATIC NAME: 3-morpholin-4-yl-1-(4-phenylsulfanylphenyl)propan-1-ol
MOLECULAR FORMULA: C19H23NO2S
MOLECULAR WEIGHT: 329.45642
SMILES: C1COCCN1CCC(C2=CC=C(C=C2)SC3=CC=CC=C3)O
Structure:

CAS RN: 6303-86-2
CAS Name: 3-hydroxy-3,4-diphenyl-1-cyclohexanone
OPENEYE Name: 3-hydroxy-3,4-diphenyl-cyclohexanone
IUPAC Name: 3-hydroxy-3,4-diphenylcyclohexan-1-one
SYSTEMATIC NAME: 3-oxidanyl-3,4-diphenyl-cyclohexan-1-one
MOLECULAR FORMULA: C18H18O2
MOLECULAR WEIGHT: 266.33432
SMILES: C1CC(=O)CC(C1C2=CC=CC=C2)(C3=CC=CC=C3)O
Structure:

CAS RN: 75163-14-3
CAS Name: 2,3-bis(1-piperidinyl)quinoxaline
OPENEYE Name: 2,3-bis(1-piperidyl)quinoxaline
IUPAC Name: 2,3-di(piperidin-1-yl)quinoxaline
SYSTEMATIC NAME: 2,3-di(piperidin-1-yl)quinoxaline
MOLECULAR FORMULA: C18H24N4
MOLECULAR WEIGHT: 296.40996
SMILES: C1CCN(CC1)C2=NC3=CC=CC=C3N=C2N4CCCCC4
Structure:

CAS RN: 6635-10-5
CAS Name: 6-(diethylamino)-4,4-diphenyl-3-hexanone
OPENEYE Name: 6-(diethylamino)-4,4-diphenyl-hexan-3-one
IUPAC Name: 6-(diethylamino)-4,4-diphenylhexan-3-one
SYSTEMATIC NAME: 6-(diethylamino)-4,4-diphenyl-hexan-3-one
MOLECULAR FORMULA: C22H29NO
MOLECULAR WEIGHT: 323.47176
SMILES: CCC(=O)C(CCN(CC)CC)(C1=CC=CC=C1)C2=CC=CC=C2
Structure:

CAS RN: 6299-16-7
CAS Name: 9-(4-phenylphenyl)carbazole
OPENEYE Name: 9-(4-phenylphenyl)carbazole
IUPAC Name: 9-(4-phenylphenyl)carbazole
SYSTEMATIC NAME: 9-(4-phenylphenyl)carbazole
MOLECULAR FORMULA: C24H17N
MOLECULAR WEIGHT: 319.39848
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)N3C4=CC=CC=C4C5=CC=CC=C53
Structure:

CAS RN: 6299-12-3
CAS Name: acetic acid diphenylarsoryl ester
OPENEYE Name: diphenylarsoryl acetate
IUPAC Name: diphenylarsoryl acetate
SYSTEMATIC NAME: diphenylarsoryl ethanoate
MOLECULAR FORMULA: C14H13AsO3
MOLECULAR WEIGHT: 304.17282
SMILES: CC(=O)O[As](=O)(C1=CC=CC=C1)C2=CC=CC=C2
Structure:

CAS RN: 6299-07-6
CAS Name: chloromercury; tris(4-methylphenyl)arsine
OPENEYE Name: chloromercury; tris-p-tolylarsane
IUPAC Name: chloromercury; tris(4-methylphenyl)arsane
SYSTEMATIC NAME: chloranylmercury; tris(4-methylphenyl)arsane
MOLECULAR FORMULA: C21H21AsClHg
MOLECULAR WEIGHT: 584.35604
SMILES: CC1=CC=C(C=C1)[As](C2=CC=C(C=C2)C)C3=CC=C(C=C3)C.Cl[Hg]
Structure:

CAS RN: 6298-98-2
CAS Name: N-diphenoxyphosphoryl-2-ethyl-1-hexanamine
OPENEYE Name: N-diphenoxyphosphoryl-2-ethyl-hexan-1-amine
IUPAC Name: N-diphenoxyphosphoryl-2-ethylhexan-1-amine
SYSTEMATIC NAME: N-diphenoxyphosphoryl-2-ethyl-hexan-1-amine
MOLECULAR FORMULA: C20H28NO3P
MOLECULAR WEIGHT: 361.414981
SMILES: CCCCC(CC)CNP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2
Structure:

CAS RN: 6298-97-1
CAS Name: N-diphenoxyphosphoryl-1-decanamine
OPENEYE Name: N-diphenoxyphosphoryldecan-1-amine
IUPAC Name: N-diphenoxyphosphoryldecan-1-amine
SYSTEMATIC NAME: N-diphenoxyphosphoryldecan-1-amine
MOLECULAR FORMULA: C22H32NO3P
MOLECULAR WEIGHT: 389.468141
SMILES: CCCCCCCCCCNP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2
Structure:

CAS RN: 7245-27-4
CAS Name: [4-[amino(carboxy)methyl]phenyl]-trimethylammonium
OPENEYE Name: [4-[amino(carboxy)methyl]phenyl]-trimethyl-ammonium
IUPAC Name: [4-[amino(carboxy)methyl]phenyl]-trimethylazanium
SYSTEMATIC NAME: [4-(1-azanyl-2-oxidanyl-2-oxidanylidene-ethyl)phenyl]-trimethyl-azanium
MOLECULAR FORMULA: C11H17N2O2+
MOLECULAR WEIGHT: 209.26488
SMILES: C[N+](C)(C)C1=CC=C(C=C1)C(C(=O)O)N
Structure:

CAS RN: 6308-68-5
CAS Name: 3-[[4-(1H-indol-3-ylmethyl)-1-piperazinyl]methyl]-1H-indole
OPENEYE Name: 3-[[4-(1H-indol-3-ylmethyl)piperazin-1-yl]methyl]-1H-indole
IUPAC Name: 3-[[4-(1H-indol-3-ylmethyl)piperazin-1-yl]methyl]-1H-indole
SYSTEMATIC NAME: 3-[[4-(1H-indol-3-ylmethyl)piperazin-1-yl]methyl]-1H-indole
MOLECULAR FORMULA: C22H24N4
MOLECULAR WEIGHT: 344.45276
SMILES: C1CN(CCN1CC2=CNC3=CC=CC=C32)CC4=CNC5=CC=CC=C54
Structure:

CAS RN: 5000-64-6
CAS Name: N,N,1-triethyl-4-pyridin-1-iumcarboxamide
OPENEYE Name: N,N,1-triethylpyridin-1-ium-4-carboxamide
IUPAC Name: N,N,1-triethylpyridin-1-ium-4-carboxamide
SYSTEMATIC NAME: N,N,1-triethylpyridin-1-ium-4-carboxamide
MOLECULAR FORMULA: C12H19N2O+
MOLECULAR WEIGHT: 207.29206
SMILES: CC[N+]1=CC=C(C=C1)C(=O)N(CC)CC
Structure:

CAS RN: 6633-51-8
CAS Name: 5-(4-phenylphenyl)benzo[b]arsindole
OPENEYE Name: 5-(4-phenylphenyl)benzo[b]arsindole
IUPAC Name: 5-(4-phenylphenyl)benzo[b]arsindole
SYSTEMATIC NAME: 5-(4-phenylphenyl)benzo[b]arsindole
MOLECULAR FORMULA: C24H17As
MOLECULAR WEIGHT: 380.31338
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)[As]3C4=CC=CC=C4C5=CC=CC=C53
Structure:

CAS RN: 6303-36-2
CAS Name: 2-amino-2-ethylpentanoic acid
OPENEYE Name: 2-amino-2-ethyl-pentanoic acid
IUPAC Name: 2-amino-2-ethylpentanoic acid
SYSTEMATIC NAME: 2-azanyl-2-ethyl-pentanoic acid
MOLECULAR FORMULA: C7H15NO2
MOLECULAR WEIGHT: 145.1995
SMILES: CCCC(CC)(C(=O)O)N
Structure:

CAS RN: 78737-63-0
CAS Name: 2-amino-2-ethylpentanoic acid
OPENEYE Name: 2-amino-2-ethyl-pentanoic acid
IUPAC Name: 2-amino-2-ethylpentanoic acid
SYSTEMATIC NAME: 2-azanyl-2-ethyl-pentanoic acid
MOLECULAR FORMULA: C7H15NO2
MOLECULAR WEIGHT: 145.1995
SMILES: CCCC(CC)(C(=O)O)N
Structure:

CAS RN: 6298-38-0
CAS Name: 7-bromo-1-hydroxy-7H-1,2,4-benzotriazin-3-amine
OPENEYE Name: 7-bromo-1-hydroxy-7H-1,2,4-benzotriazin-3-amine
IUPAC Name: 7-bromo-1-hydroxy-7H-1,2,4-benzotriazin-3-amine
SYSTEMATIC NAME: 7-bromanyl-1-oxidanyl-7H-1,2,4-benzotriazin-3-amine
MOLECULAR FORMULA: C7H7BrN4O
MOLECULAR WEIGHT: 243.06068
SMILES: C1=CC2=NC(=NN(C2=CC1Br)O)N
Structure:

CAS RN: 18671-92-6
CAS Name: 7-chloro-1-hydroxy-7H-1,2,4-benzotriazin-3-amine
OPENEYE Name: 7-chloro-1-hydroxy-7H-1,2,4-benzotriazin-3-amine
IUPAC Name: 7-chloro-1-hydroxy-7H-1,2,4-benzotriazin-3-amine
SYSTEMATIC NAME: 7-chloranyl-1-oxidanyl-7H-1,2,4-benzotriazin-3-amine
MOLECULAR FORMULA: C7H7ClN4O
MOLECULAR WEIGHT: 198.60968
SMILES: C1=CC2=NC(=NN(C2=CC1Cl)O)N
Structure:

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