N-(2-morpholin-4-ium-4-ylethyl)-4-nitro-benzamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-4-nitro-benzamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-4-nitro-benzamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-4-nitrobenzamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-4-nitrobenzamide Traditional Name: N-(2-morpholin-4-ium-4-ylethyl)-4-nitro-benzamide Formula: C13H18N3O4+ MolecularWeight: 280.29972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O4/c17-13(11-1-3-12(4-2-11)16(18)19)14-5-6-15-7-9-20-10-8-15/h1-4H,5-10H2,(H,14,17)/p+1