N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-4-nitro-benzamide

Systemtic Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-4-nitro-benzamide Openeye Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-4-nitro-benzamide CAS Name: N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]-4-nitrobenzamide IUPAC Name: N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)-4-nitrobenzamide Traditional Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-4-nitro-benzamide Formula: C15H22N3O4+ MolecularWeight: 308.35288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1=CC=C(C=C1)[N+](=O)[O-])[NH+]2CCOCC2

Isomeric SMILES

CC(C)(CNC(=O)C1=CC=C(C=C1)[N+](=O)[O-])[NH+]2CCOCC2

InChI

InChI=1S/C15H21N3O4/c1-15(2,17-7-9-22-10-8-17)11-16-14(19)12-3-5-13(6-4-12)18(20)21/h3-6H,7-11H2,1-2H3,(H,16,19)/p+1