2-[[(3S)-piperidin-1-ium-3-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[(3S)-piperidin-1-ium-3-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[(3S)-piperidin-1-ium-3-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[(3S)-3-piperidin-1-iumyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[(3S)-piperidin-1-ium-3-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[(3S)-piperidin-1-ium-3-yl]methyl]isoindoline-1,3-quinone Formula: C14H17N2O2+ MolecularWeight: 245.29698

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)CN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)CN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C14H16N2O2/c17-13-11-5-1-2-6-12(11)14(18)16(13)9-10-4-3-7-15-8-10/h1-2,5-6,10,15H,3-4,7-9H2/p+1/t10-/m0/s1