2-(2-morpholin-4-ium-4-ylethyl)-4-nitro-3H-isoindol-1-one

Systemtic Name: 2-(2-morpholin-4-ium-4-ylethyl)-4-nitro-3H-isoindol-1-one Openeye Name: 2-(2-morpholin-4-ium-4-ylethyl)-4-nitro-isoindolin-1-one CAS Name: 2-[2-(4-morpholin-4-iumyl)ethyl]-4-nitro-3H-isoindol-1-one IUPAC Name: 2-(2-morpholin-4-ium-4-ylethyl)-4-nitro-3H-isoindol-1-one Traditional Name: 2-(2-morpholin-4-ium-4-ylethyl)-4-nitro-isoindolin-1-one Formula: C14H18N3O4+ MolecularWeight: 292.31042

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN2CC3=C(C2=O)C=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCN2CC3=C(C2=O)C=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O4/c18-14-11-2-1-3-13(17(19)20)12(11)10-16(14)5-4-15-6-8-21-9-7-15/h1-3H,4-10H2/p+1