Friday, July 6, 2012

http://ChemLookup.com Compounds




CAS RN: 53619-63-9
CAS Name: 4-[(4-chlorophenyl)thio]-7-nitro-2,1,3-benzoxadiazole
OPENEYE Name: 4-(4-chlorophenyl)sulfanyl-7-nitro-2,1,3-benzoxadiazole
IUPAC Name: 4-(4-chlorophenyl)sulfanyl-7-nitro-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 4-(4-chlorophenyl)sulfanyl-7-nitro-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C12H6ClN3O3S
MOLECULAR WEIGHT: 307.71234
SMILES: C1=CC(=CC=C1SC2=CC=C(C3=NON=C23)[N+](=O)[O-])Cl
Structure:

CAS RN: 53619-67-3
CAS Name: 4-(4-methylphenyl)sulfinyl-7-nitro-2,1,3-benzoxadiazole
OPENEYE Name: 7-nitro-4-(p-tolylsulfinyl)-2,1,3-benzoxadiazole
IUPAC Name: 4-(4-methylphenyl)sulfinyl-7-nitro-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 4-(4-methylphenyl)sulfinyl-7-nitro-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C13H9N3O4S
MOLECULAR WEIGHT: 303.29326
SMILES: CC1=CC=C(C=C1)S(=O)C2=CC=C(C3=NON=C23)[N+](=O)[O-]
Structure:

CAS RN: 53619-61-7
CAS Name: 4-[(4-methylphenyl)thio]-7-nitro-2,1,3-benzoxadiazole
OPENEYE Name: 7-nitro-4-(p-tolylsulfanyl)-2,1,3-benzoxadiazole
IUPAC Name: 4-(4-methylphenyl)sulfanyl-7-nitro-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 4-(4-methylphenyl)sulfanyl-7-nitro-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C13H9N3O3S
MOLECULAR WEIGHT: 287.29386
SMILES: CC1=CC=C(C=C1)SC2=CC=C(C3=NON=C23)[N+](=O)[O-]
Structure:

CAS RN: 53619-72-0
CAS Name: 7-nitro-4-(phenylmethyl)sulfonyl-2,1,3-benzoxadiazole
OPENEYE Name: 4-benzylsulfonyl-7-nitro-2,1,3-benzoxadiazole
IUPAC Name: 4-benzylsulfonyl-7-nitro-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 7-nitro-4-(phenylmethyl)sulfonyl-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C13H9N3O5S
MOLECULAR WEIGHT: 319.29266
SMILES: C1=CC=C(C=C1)CS(=O)(=O)C2=CC=C(C3=NON=C23)[N+](=O)[O-]
Structure:

CAS RN: 16322-24-0
CAS Name: 7-nitro-4-(phenylmethylthio)-2,1,3-benzoxadiazole
OPENEYE Name: 4-benzylsulfanyl-7-nitro-2,1,3-benzoxadiazole
IUPAC Name: 4-benzylsulfanyl-7-nitro-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 7-nitro-4-(phenylmethylsulfanyl)-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C13H9N3O3S
MOLECULAR WEIGHT: 287.29386
SMILES: C1=CC=C(C=C1)CSC2=CC=C(C3=NON=C23)[N+](=O)[O-]
Structure:

CAS RN: 53619-71-9
CAS Name: 4-(benzenesulfonyl)-7-nitro-2,1,3-benzoxadiazole
OPENEYE Name: 4-(benzenesulfonyl)-7-nitro-2,1,3-benzoxadiazole
IUPAC Name: 4-(benzenesulfonyl)-7-nitro-2,1,3-benzoxadiazole
SYSTEMATIC NAME: 7-nitro-4-(phenylsulfonyl)-2,1,3-benzoxadiazole
MOLECULAR FORMULA: C12H7N3O5S
MOLECULAR WEIGHT: 305.26608
SMILES: C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C3=NON=C23)[N+](=O)[O-]
Structure:

CAS RN: 61785-75-9
CAS Name: 4-(4-nitro-2,1,3-benzoxadiazol-7-yl)-1-piperazinecarboxaldehyde
OPENEYE Name: 4-(4-nitro-2,1,3-benzoxadiazol-7-yl)piperazine-1-carbaldehyde
IUPAC Name: 4-(4-nitro-2,1,3-benzoxadiazol-7-yl)piperazine-1-carbaldehyde
SYSTEMATIC NAME: 4-(4-nitro-2,1,3-benzoxadiazol-7-yl)piperazine-1-carbaldehyde
MOLECULAR FORMULA: C11H11N5O4
MOLECULAR WEIGHT: 277.23614
SMILES: C1CN(CCN1C=O)C2=CC=C(C3=NON=C23)[N+](=O)[O-]
Structure:

CAS RN: 61785-50-0
CAS Name: 5-(4-methyl-1-piperazinyl)-6-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium
OPENEYE Name: 5-(4-methylpiperazin-1-yl)-6-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium
IUPAC Name: 5-(4-methylpiperazin-1-yl)-6-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium
SYSTEMATIC NAME: 5-(4-methylpiperazin-1-yl)-6-nitro-3-oxidanidyl-2,1,3-benzoxadiazol-3-ium
MOLECULAR FORMULA: C11H13N5O4
MOLECULAR WEIGHT: 279.25202
SMILES: CN1CCN(CC1)C2=CC3=[N+](ON=C3C=C2[N+](=O)[O-])[O-]
Structure:

CAS RN: 61785-82-8
CAS Name: 6-nitro-3-oxido-5-(1-piperidinyl)-2,1,3-benzoxadiazol-3-ium
OPENEYE Name: 6-nitro-3-oxido-5-(1-piperidyl)-2,1,3-benzoxadiazol-3-ium
IUPAC Name: 6-nitro-3-oxido-5-piperidin-1-yl-2,1,3-benzoxadiazol-3-ium
SYSTEMATIC NAME: 6-nitro-3-oxidanidyl-5-piperidin-1-yl-2,1,3-benzoxadiazol-3-ium
MOLECULAR FORMULA: C11H12N4O4
MOLECULAR WEIGHT: 264.23738
SMILES: C1CCN(CC1)C2=CC3=[N+](ON=C3C=C2[N+](=O)[O-])[O-]
Structure:

CAS RN: 61785-83-9
CAS Name: 6-nitro-5-[4-(6-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium-5-yl)-1-piperazinyl]-3-oxido-2,1,3-benzoxadiazol-3-ium
OPENEYE Name: 6-nitro-5-[4-(6-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium-5-yl)piperazin-1-yl]-3-oxido-2,1,3-benzoxadiazol-3-ium
IUPAC Name: 6-nitro-5-[4-(6-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium-5-yl)piperazin-1-yl]-3-oxido-2,1,3-benzoxadiazol-3-ium
SYSTEMATIC NAME: 6-nitro-5-[4-(6-nitro-3-oxidanidyl-2,1,3-benzoxadiazol-3-ium-5-yl)piperazin-1-yl]-3-oxidanidyl-2,1,3-benzoxadiazol-3-ium
MOLECULAR FORMULA: C16H12N8O8
MOLECULAR WEIGHT: 444.31528
SMILES: C1CN(CCN1C2=CC3=[N+](ON=C3C=C2[N+](=O)[O-])[O-])C4=CC5=[N+](ON=C5C=C4[N+](=O)[O-])[O-]
Structure:

CAS RN: 61785-58-8
CAS Name: N-methyl-6-nitro-3-oxido-N-phenyl-2,1,3-benzoxadiazol-3-ium-5-amine
OPENEYE Name: N-methyl-6-nitro-3-oxido-N-phenyl-2,1,3-benzoxadiazol-3-ium-5-amine
IUPAC Name: N-methyl-6-nitro-3-oxido-N-phenyl-2,1,3-benzoxadiazol-3-ium-5-amine
SYSTEMATIC NAME: N-methyl-6-nitro-3-oxidanidyl-N-phenyl-2,1,3-benzoxadiazol-3-ium-5-amine
MOLECULAR FORMULA: C13H10N4O4
MOLECULAR WEIGHT: 286.2429
SMILES: CN(C1=CC=CC=C1)C2=CC3=[N+](ON=C3C=C2[N+](=O)[O-])[O-]
Structure:

CAS RN: 61785-81-7
CAS Name: N-ethyl-6-nitro-3-oxido-N-phenyl-2,1,3-benzoxadiazol-3-ium-5-amine
OPENEYE Name: N-ethyl-6-nitro-3-oxido-N-phenyl-2,1,3-benzoxadiazol-3-ium-5-amine
IUPAC Name: N-ethyl-6-nitro-3-oxido-N-phenyl-2,1,3-benzoxadiazol-3-ium-5-amine
SYSTEMATIC NAME: N-ethyl-6-nitro-3-oxidanidyl-N-phenyl-2,1,3-benzoxadiazol-3-ium-5-amine
MOLECULAR FORMULA: C14H12N4O4
MOLECULAR WEIGHT: 300.26948
SMILES: CCN(C1=CC=CC=C1)C2=CC3=[N+](ON=C3C=C2[N+](=O)[O-])[O-]
Structure:

CAS RN: 61785-59-9
CAS Name: 5-(4-morpholinyl)-6-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium
OPENEYE Name: 5-morpholino-6-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium
IUPAC Name: 5-morpholin-4-yl-6-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium
SYSTEMATIC NAME: 5-morpholin-4-yl-6-nitro-3-oxidanidyl-2,1,3-benzoxadiazol-3-ium
MOLECULAR FORMULA: C10H10N4O5
MOLECULAR WEIGHT: 266.2102
SMILES: C1COCCN1C2=CC3=[N+](ON=C3C=C2[N+](=O)[O-])[O-]
Structure:

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