N-methyl-4-nitro-N-(1,2,2,6,6-pentamethylpiperidin-1-ium-4-yl)benzamide

Systemtic Name: N-methyl-4-nitro-N-(1,2,2,6,6-pentamethylpiperidin-1-ium-4-yl)benzamide Openeye Name: N-methyl-4-nitro-N-(1,2,2,6,6-pentamethylpiperidin-1-ium-4-yl)benzamide CAS Name: N-methyl-4-nitro-N-(1,2,2,6,6-pentamethyl-4-piperidin-1-iumyl)benzamide IUPAC Name: N-methyl-4-nitro-N-(1,2,2,6,6-pentamethylpiperidin-1-ium-4-yl)benzamide Traditional Name: N-methyl-4-nitro-N-(1,2,2,6,6-pentamethylpiperidin-1-ium-4-yl)benzamide Formula: C18H28N3O3+ MolecularWeight: 334.43322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH+]1C)(C)C)N(C)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC(CC([NH+]1C)(C)C)N(C)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C18H27N3O3/c1-17(2)11-15(12-18(3,4)20(17)6)19(5)16(22)13-7-9-14(10-8-13)21(23)24/h7-10,15H,11-12H2,1-6H3/p+1