N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-1,2-dihydroacenaphthylene-5-carboxamide

Systemtic Name: N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-1,2-dihydroacenaphthylene-5-carboxamide Openeye Name: N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-1,2-dihydroacenaphthylene-5-carboxamide CAS Name: N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)-1,2-dihydroacenaphthylene-5-carboxamide IUPAC Name: N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-1,2-dihydroacenaphthylene-5-carboxamide Traditional Name: N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)acenaphthene-5-carboxamide Formula: C22H29N2O+ MolecularWeight: 337.47846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=C3C=CC=C4C3=C(CC4)C=C2)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=C3C=CC=C4C3=C(CC4)C=C2)C

InChI

InChI=1S/C22H28N2O/c1-21(2)12-16(13-22(3,4)24-21)23-20(25)18-11-10-15-9-8-14-6-5-7-17(18)19(14)15/h5-7,10-11,16,24H,8-9,12-13H2,1-4H3,(H,23,25)/p+1