2-[[(2S)-morpholin-4-ium-2-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[(2S)-morpholin-4-ium-2-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[(2S)-morpholin-4-ium-2-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[(2S)-2-morpholin-4-iumyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[(2S)-morpholin-4-ium-2-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[(2S)-morpholin-4-ium-2-yl]methyl]isoindoline-1,3-quinone Formula: C13H15N2O3+ MolecularWeight: 247.2698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC(C[NH2+]1)CN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1CO[C@@H](C[NH2+]1)CN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C13H14N2O3/c16-12-10-3-1-2-4-11(10)13(17)15(12)8-9-7-14-5-6-18-9/h1-4,9,14H,5-8H2/p+1/t9-/m0/s1