1,3-benzodioxol-5-ylmethyl-bis[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-bis[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-bis[(1,3-dioxoisoindolin-2-yl)methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-bis[(1,3-dioxo-2-isoindolyl)methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-bis[(1,3-dioxoisoindol-2-yl)methyl]azanium Traditional Name: bis(phthalimidomethyl)-piperonyl-ammonium Formula: C26H20N3O6+ MolecularWeight: 470.4535

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C[NH+](CN3C(=O)C4=CC=CC=C4C3=O)CN5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C[NH+](CN3C(=O)C4=CC=CC=C4C3=O)CN5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C26H19N3O6/c30-23-17-5-1-2-6-18(17)24(31)28(23)13-27(12-16-9-10-21-22(11-16)35-15-34-21)14-29-25(32)19-7-3-4-8-20(19)26(29)33/h1-11H,12-15H2/p+1