2-(2-morpholin-4-ium-4-ylethyl)-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-(2-morpholin-4-ium-4-ylethyl)-4-nitro-isoindole-1,3-dione Openeye Name: 2-(2-morpholin-4-ium-4-ylethyl)-4-nitro-isoindoline-1,3-dione CAS Name: 2-[2-(4-morpholin-4-iumyl)ethyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-(2-morpholin-4-ium-4-ylethyl)-4-nitroisoindole-1,3-dione Traditional Name: 2-(2-morpholin-4-ium-4-ylethyl)-4-nitro-isoindoline-1,3-quinone Formula: C14H16N3O5+ MolecularWeight: 306.29394

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O5/c18-13-10-2-1-3-11(17(20)21)12(10)14(19)16(13)5-4-15-6-8-22-9-7-15/h1-3H,4-9H2/p+1