1-ethyl-2-[(3-ethylsulfonylphenoxy)methyl]-5-nitro-imidazole

Systemtic Name: 1-ethyl-2-[(3-ethylsulfonylphenoxy)methyl]-5-nitro-imidazole Openeye Name: 1-ethyl-2-[(3-ethylsulfonylphenoxy)methyl]-5-nitro-imidazole CAS Name: 1-ethyl-2-[(3-ethylsulfonylphenoxy)methyl]-5-nitroimidazole IUPAC Name: 1-ethyl-2-[(3-ethylsulfonylphenoxy)methyl]-5-nitroimidazole Traditional Name: 2-[(3-esylphenoxy)methyl]-1-ethyl-5-nitro-imidazole Formula: C14H17N3O5S MolecularWeight: 339.36688

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CN=C1COC2=CC(=CC=C2)S(=O)(=O)CC)[N+](=O)[O-]

Isomeric SMILES

CCN1C(=CN=C1COC2=CC(=CC=C2)S(=O)(=O)CC)[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O5S/c1-3-16-13(15-9-14(16)17(18)19)10-22-11-6-5-7-12(8-11)23(20,21)4-2/h5-9H,3-4,10H2,1-2H3