2-[(4-methoxyphenyl)methyl]-4-[4-[(2-methoxyphenyl)methyl]piperazin-4-ium-1-yl]isoindole-1,3-dione

Systemtic Name: 2-[(4-methoxyphenyl)methyl]-4-[4-[(2-methoxyphenyl)methyl]piperazin-4-ium-1-yl]isoindole-1,3-dione Openeye Name: 2-[(4-methoxyphenyl)methyl]-4-[4-[(2-methoxyphenyl)methyl]piperazin-4-ium-1-yl]isoindoline-1,3-dione CAS Name: 2-[(4-methoxyphenyl)methyl]-4-[4-[(2-methoxyphenyl)methyl]-1-piperazin-4-iumyl]isoindole-1,3-dione IUPAC Name: 2-[(4-methoxyphenyl)methyl]-4-[4-[(2-methoxyphenyl)methyl]piperazin-4-ium-1-yl]isoindole-1,3-dione Traditional Name: 4-(4-o-anisylpiperazin-4-ium-1-yl)-2-p-anisyl-isoindoline-1,3-quinone Formula: C28H30N3O4+ MolecularWeight: 472.5555

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)C3=C(C2=O)C(=CC=C3)N4CC[NH+](CC4)CC5=CC=CC=C5OC

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)C3=C(C2=O)C(=CC=C3)N4CC[NH+](CC4)CC5=CC=CC=C5OC

InChI

InChI=1S/C28H29N3O4/c1-34-22-12-10-20(11-13-22)18-31-27(32)23-7-5-8-24(26(23)28(31)33)30-16-14-29(15-17-30)19-21-6-3-4-9-25(21)35-2/h3-13H,14-19H2,1-2H3/p+1