1-[1-[3-[4-[(E)-C-methyl-N-oxidanyl-carbonimidoyl]piperazin-1-yl]phenyl]benzimidazol-5-yl]ethanone

Systemtic Name: 1-[1-[3-[4-[(E)-C-methyl-N-oxidanyl-carbonimidoyl]piperazin-1-yl]phenyl]benzimidazol-5-yl]ethanone Openeye Name: 1-[1-[3-[4-[(E)-N-hydroxy-C-methyl-carbonimidoyl]piperazin-1-yl]phenyl]benzimidazol-5-yl]ethanone CAS Name: 1-[1-[3-[4-[(1E)-1-hydroxyiminoethyl]-1-piperazinyl]phenyl]-5-benzimidazolyl]ethanone IUPAC Name: 1-[1-[3-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]piperazin-1-yl]phenyl]benzimidazol-5-yl]ethanone Traditional Name: 1-[1-[3-(4-acetohydroximoylpiperazino)phenyl]benzimidazol-5-yl]ethanone Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)N(C=N2)C3=CC(=CC=C3)N4CCN(CC4)C(=NO)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)N(C=N2)C3=CC(=CC=C3)N4CCN(CC4)/C(=N/O)/C

InChI

InChI=1S/C21H23N5O2/c1-15(27)17-6-7-21-20(12-17)22-14-26(21)19-5-3-4-18(13-19)25-10-8-24(9-11-25)16(2)23-28/h3-7,12-14,28H,8-11H2,1-2H3/b23-16+