[4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]phenyl]methyl-(piperidin-1-ium-4-ylmethyl)azanium

Systemtic Name: [4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]phenyl]methyl-(piperidin-1-ium-4-ylmethyl)azanium Openeye Name: [4-[2-(tert-butylamino)-2-oxo-ethoxy]phenyl]methyl-(piperidin-1-ium-4-ylmethyl)ammonium CAS Name: [4-[2-(tert-butylamino)-2-oxoethoxy]phenyl]methyl-(4-piperidin-1-iumylmethyl)ammonium IUPAC Name: [4-[2-(tert-butylamino)-2-oxoethoxy]phenyl]methyl-(piperidin-1-ium-4-ylmethyl)azanium Traditional Name: [4-[2-(tert-butylamino)-2-keto-ethoxy]benzyl]-(piperidin-1-ium-4-ylmethyl)ammonium Formula: C19H33N3O2+2 MolecularWeight: 335.48422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC1=CC=C(C=C1)C[NH2+]CC2CC[NH2+]CC2

Isomeric SMILES

CC(C)(C)NC(=O)COC1=CC=C(C=C1)C[NH2+]CC2CC[NH2+]CC2

InChI

InChI=1S/C19H31N3O2/c1-19(2,3)22-18(23)14-24-17-6-4-15(5-7-17)12-21-13-16-8-10-20-11-9-16/h4-7,16,20-21H,8-14H2,1-3H3,(H,22,23)/p+2