2-morpholin-4-yl-5-nitro-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide

Systemtic Name: 2-morpholin-4-yl-5-nitro-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide Openeye Name: 2-morpholino-5-nitro-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide CAS Name: 2-(4-morpholinyl)-5-nitro-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)benzamide IUPAC Name: 2-morpholin-4-yl-5-nitro-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide Traditional Name: 2-morpholino-5-nitro-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide Formula: C20H31N4O4+ MolecularWeight: 391.48454

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)C

InChI

InChI=1S/C20H30N4O4/c1-19(2)12-14(13-20(3,4)22-19)21-18(25)16-11-15(24(26)27)5-6-17(16)23-7-9-28-10-8-23/h5-6,11,14,22H,7-10,12-13H2,1-4H3,(H,21,25)/p+1