1-(4-butoxyphenyl)sulfonyl-2-methyl-5-nitro-imidazole

Systemtic Name: 1-(4-butoxyphenyl)sulfonyl-2-methyl-5-nitro-imidazole Openeye Name: 1-(4-butoxyphenyl)sulfonyl-2-methyl-5-nitro-imidazole CAS Name: 1-(4-butoxyphenyl)sulfonyl-2-methyl-5-nitroimidazole IUPAC Name: 1-(4-butoxyphenyl)sulfonyl-2-methyl-5-nitroimidazole Traditional Name: 1-(4-butoxyphenyl)sulfonyl-2-methyl-5-nitro-imidazole Formula: C14H17N3O5S MolecularWeight: 339.36688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2C(=NC=C2[N+](=O)[O-])C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2C(=NC=C2[N+](=O)[O-])C

InChI

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