1-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyrrole-2,5-dione

Systemtic Name: 1-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyrrole-2,5-dione Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)pyrrole-2,5-dione CAS Name: 1-[1-(phenylmethyl)-4-piperidin-1-iumyl]pyrrole-2,5-dione IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)pyrrole-2,5-dione Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-pyrroline-2,5-quinone Formula: C16H19N2O2+ MolecularWeight: 271.33426

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C(=O)C=CC2=O)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1N2C(=O)C=CC2=O)CC3=CC=CC=C3

InChI

InChI=1S/C16H18N2O2/c19-15-6-7-16(20)18(15)14-8-10-17(11-9-14)12-13-4-2-1-3-5-13/h1-7,14H,8-12H2/p+1