N-(1,3-benzodioxol-5-yl)-1-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[(1,3-dioxoisoindolin-2-yl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(1,3-dioxo-2-isoindolyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[(1,3-dioxoisoindol-2-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(phthalimidomethyl)piperidin-1-ium-4-carboxamide Formula: C22H22N3O5+ MolecularWeight: 408.42718

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC3=C(C=C2)OCO3)CN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC3=C(C=C2)OCO3)CN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C22H21N3O5/c26-20(23-15-5-6-18-19(11-15)30-13-29-18)14-7-9-24(10-8-14)12-25-21(27)16-3-1-2-4-17(16)22(25)28/h1-6,11,14H,7-10,12-13H2,(H,23,26)/p+1