N-(3-morpholin-4-ium-4-ylpropyl)-2-nitro-benzamide

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-nitro-benzamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-nitro-benzamide CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-2-nitrobenzamide IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-nitrobenzamide Traditional Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-nitro-benzamide Formula: C14H20N3O4+ MolecularWeight: 294.3263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O4/c18-14(12-4-1-2-5-13(12)17(19)20)15-6-3-7-16-8-10-21-11-9-16/h1-2,4-5H,3,6-11H2,(H,15,18)/p+1