5-(benzimidazol-1-yl)-4-oxidanyl-1-(4-piperazin-1-ylmorpholin-4-ium-4-yl)pentan-1-one

Systemtic Name: 5-(benzimidazol-1-yl)-4-oxidanyl-1-(4-piperazin-1-ylmorpholin-4-ium-4-yl)pentan-1-one Openeye Name: 5-(benzimidazol-1-yl)-4-hydroxy-1-(4-piperazin-1-ylmorpholin-4-ium-4-yl)pentan-1-one CAS Name: 5-(1-benzimidazolyl)-4-hydroxy-1-[4-(1-piperazinyl)-4-morpholin-4-iumyl]-1-pentanone IUPAC Name: 5-(benzimidazol-1-yl)-4-hydroxy-1-(4-piperazin-1-ylmorpholin-4-ium-4-yl)pentan-1-one Traditional Name: 5-(benzimidazol-1-yl)-4-hydroxy-1-(4-piperazinomorpholin-4-ium-4-yl)pentan-1-one Formula: C20H30N5O3+ MolecularWeight: 388.4839

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)[N+]2(CCOCC2)C(=O)CCC(CN3C=NC4=CC=CC=C43)O

Isomeric SMILES

C1CN(CCN1)[N+]2(CCOCC2)C(=O)CCC(CN3C=NC4=CC=CC=C43)O

InChI

InChI=1S/C20H30N5O3/c26-17(15-23-16-22-18-3-1-2-4-19(18)23)5-6-20(27)25(11-13-28-14-12-25)24-9-7-21-8-10-24/h1-4,16-17,21,26H,5-15H2/q+1