1-[1-(3-methoxy-2-oxidanyl-propyl)-5-nitro-benzimidazol-2-yl]ethanone

Systemtic Name: 1-[1-(3-methoxy-2-oxidanyl-propyl)-5-nitro-benzimidazol-2-yl]ethanone Openeye Name: 1-[1-(2-hydroxy-3-methoxy-propyl)-5-nitro-benzimidazol-2-yl]ethanone CAS Name: 1-[1-(2-hydroxy-3-methoxypropyl)-5-nitro-2-benzimidazolyl]ethanone IUPAC Name: 1-[1-(2-hydroxy-3-methoxypropyl)-5-nitrobenzimidazol-2-yl]ethanone Traditional Name: 1-[1-(2-hydroxy-3-methoxy-propyl)-5-nitro-benzimidazol-2-yl]ethanone Formula: C13H15N3O5 MolecularWeight: 293.2753

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NC2=C(N1CC(COC)O)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=NC2=C(N1CC(COC)O)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O5/c1-8(17)13-14-11-5-9(16(19)20)3-4-12(11)15(13)6-10(18)7-21-2/h3-5,10,18H,6-7H2,1-2H3