5-[(1-methylpiperidin-1-ium-4-yl)amino]isoindole-1,3-dione

Systemtic Name: 5-[(1-methylpiperidin-1-ium-4-yl)amino]isoindole-1,3-dione Openeye Name: 5-[(1-methylpiperidin-1-ium-4-yl)amino]isoindoline-1,3-dione CAS Name: 5-[(1-methyl-4-piperidin-1-iumyl)amino]isoindole-1,3-dione IUPAC Name: 5-[(1-methylpiperidin-1-ium-4-yl)amino]isoindole-1,3-dione Traditional Name: 5-[(1-methylpiperidin-1-ium-4-yl)amino]isoindoline-1,3-quinone Formula: C14H18N3O2+ MolecularWeight: 260.31162

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)NC2=CC3=C(C=C2)C(=O)NC3=O

Isomeric SMILES

C[NH+]1CCC(CC1)NC2=CC3=C(C=C2)C(=O)NC3=O

InChI

InChI=1S/C14H17N3O2/c1-17-6-4-9(5-7-17)15-10-2-3-11-12(8-10)14(19)16-13(11)18/h2-3,8-9,15H,4-7H2,1H3,(H,16,18,19)/p+1