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5-[3-(4-methylphenyl)sulfonylpropyl]-2-nitro-1H-imidazole

5-[3-(4-methylphenyl)sulfonylpropyl]-2-nitro-1H-imidazole

Systemtic Name:5-[3-(4-methylphenyl)sulfonylpropyl]-2-nitro-1H-imidazole
Openeye Name:2-nitro-5-[3-(p-tolylsulfonyl)propyl]-1H-imidazole
CAS Name:5-[3-(4-methylphenyl)sulfonylpropyl]-2-nitro-1H-imidazole
IUPAC Name:5-[3-(4-methylphenyl)sulfonylpropyl]-2-nitro-1H-imidazole
Traditional Name:2-nitro-5-(3-tosylpropyl)-1H-imidazole
Formula: C13H15N3O4S
MolecularWeight: 309.3409
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCCC2=CN=C(N2)[N+](=O)[O-]


Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCCC2=CN=C(N2)[N+](=O)[O-]


InChI

InChI=1S/C13H15N3O4S/c1-10-4-6-12(7-5-10)21(19,20)8-2-3-11-9-14-13(15-11)16(17)18/h4-7,9H,2-3,8H2,1H3,(H,14,15)


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