N-[(4-dimethylaminophenyl)methyl]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)benzamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide Traditional Name: N-[4-(dimethylamino)benzyl]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide Formula: C25H36N3O+ MolecularWeight: 394.57284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)N(CC2=CC=C(C=C2)N(C)C)C(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)N(CC2=CC=C(C=C2)N(C)C)C(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C25H35N3O/c1-24(2)16-22(17-25(3,4)26-24)28(23(29)20-10-8-7-9-11-20)18-19-12-14-21(15-13-19)27(5)6/h7-15,22,26H,16-18H2,1-6H3/p+1