[2-oxidanylidene-2-[3-[3-[(1-oxidanylpiperidin-1-ium-1-yl)methyl]phenoxy]propylamino]ethyl] ethanoate

Systemtic Name: [2-oxidanylidene-2-[3-[3-[(1-oxidanylpiperidin-1-ium-1-yl)methyl]phenoxy]propylamino]ethyl] ethanoate Openeye Name: [2-[3-[3-[(1-hydroxypiperidin-1-ium-1-yl)methyl]phenoxy]propylamino]-2-oxo-ethyl] acetate CAS Name: acetic acid [2-[3-[3-[(1-hydroxy-1-piperidin-1-iumyl)methyl]phenoxy]propylamino]-2-oxoethyl] ester IUPAC Name: [2-[3-[3-[(1-hydroxypiperidin-1-ium-1-yl)methyl]phenoxy]propylamino]-2-oxoethyl] acetate Traditional Name: acetic acid [2-[3-[3-[(1-hydroxypiperidin-1-ium-1-yl)methyl]phenoxy]propylamino]-2-keto-ethyl] ester Formula: C19H29N2O5+ MolecularWeight: 365.44396

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(=O)NCCCOC1=CC=CC(=C1)C[N+]2(CCCCC2)O

Isomeric SMILES

CC(=O)OCC(=O)NCCCOC1=CC=CC(=C1)C[N+]2(CCCCC2)O

InChI

InChI=1S/C19H28N2O5/c1-16(22)26-15-19(23)20-9-6-12-25-18-8-5-7-17(13-18)14-21(24)10-3-2-4-11-21/h5,7-8,13,24H,2-4,6,9-12,14-15H2,1H3/p+1