1-[(1-ethylbenzimidazol-2-yl)methyl]-4-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperidin-1-ium-4-ol

Systemtic Name: 1-[(1-ethylbenzimidazol-2-yl)methyl]-4-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperidin-1-ium-4-ol Openeye Name: 1-[(1-ethylbenzimidazol-2-yl)methyl]-4-[(3-phenylisoxazol-5-yl)methyl]piperidin-1-ium-4-ol CAS Name: 1-[(1-ethyl-2-benzimidazolyl)methyl]-4-[(3-phenyl-5-isoxazolyl)methyl]-4-piperidin-1-iumol IUPAC Name: 1-[(1-ethylbenzimidazol-2-yl)methyl]-4-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperidin-1-ium-4-ol Traditional Name: 1-[(1-ethylbenzimidazol-2-yl)methyl]-4-[(3-phenylisoxazol-5-yl)methyl]piperidin-1-ium-4-ol Formula: C25H29N4O2+ MolecularWeight: 417.52336

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1C[NH+]3CCC(CC3)(CC4=CC(=NO4)C5=CC=CC=C5)O

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1C[NH+]3CCC(CC3)(CC4=CC(=NO4)C5=CC=CC=C5)O

InChI

InChI=1S/C25H28N4O2/c1-2-29-23-11-7-6-10-21(23)26-24(29)18-28-14-12-25(30,13-15-28)17-20-16-22(27-31-20)19-8-4-3-5-9-19/h3-11,16,30H,2,12-15,17-18H2,1H3/p+1