2-[(4-ethylsulfonylphenoxy)methyl]-1-methyl-5-nitro-imidazole

Systemtic Name: 2-[(4-ethylsulfonylphenoxy)methyl]-1-methyl-5-nitro-imidazole Openeye Name: 2-[(4-ethylsulfonylphenoxy)methyl]-1-methyl-5-nitro-imidazole CAS Name: 2-[(4-ethylsulfonylphenoxy)methyl]-1-methyl-5-nitroimidazole IUPAC Name: 2-[(4-ethylsulfonylphenoxy)methyl]-1-methyl-5-nitroimidazole Traditional Name: 2-[(4-esylphenoxy)methyl]-1-methyl-5-nitro-imidazole Formula: C13H15N3O5S MolecularWeight: 325.3403

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)OCC2=NC=C(N2C)[N+](=O)[O-]

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)OCC2=NC=C(N2C)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O5S/c1-3-22(19,20)11-6-4-10(5-7-11)21-9-12-14-8-13(15(12)2)16(17)18/h4-8H,3,9H2,1-2H3