2-ethyl-4-nitro-5-(phenylsulfonyl)-1-propyl-imidazole

Systemtic Name: 2-ethyl-4-nitro-5-(phenylsulfonyl)-1-propyl-imidazole Openeye Name: 5-(benzenesulfonyl)-2-ethyl-4-nitro-1-propyl-imidazole CAS Name: 5-(benzenesulfonyl)-2-ethyl-4-nitro-1-propylimidazole IUPAC Name: 5-(benzenesulfonyl)-2-ethyl-4-nitro-1-propylimidazole Traditional Name: 5-besyl-2-ethyl-4-nitro-1-propyl-imidazole Formula: C14H17N3O4S MolecularWeight: 323.36748

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NC(=C1S(=O)(=O)C2=CC=CC=C2)[N+](=O)[O-])CC

Isomeric SMILES

CCCN1C(=NC(=C1S(=O)(=O)C2=CC=CC=C2)[N+](=O)[O-])CC

InChI

InChI=1S/C14H17N3O4S/c1-3-10-16-12(4-2)15-13(17(18)19)14(16)22(20,21)11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3