N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]-N'-(2,4,6-trimethylphenyl)ethanediamide

Systemtic Name: N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]-N'-(2,4,6-trimethylphenyl)ethanediamide Openeye Name: N-[(1-isopropylpiperidin-1-ium-4-yl)methyl]-N'-(2,4,6-trimethylphenyl)oxamide CAS Name: N-[(1-propan-2-yl-4-piperidin-1-iumyl)methyl]-N'-(2,4,6-trimethylphenyl)oxamide IUPAC Name: N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]-N'-(2,4,6-trimethylphenyl)oxamide Traditional Name: N-[(1-isopropylpiperidin-1-ium-4-yl)methyl]-N'-mesityl-oxamide Formula: C20H32N3O2+ MolecularWeight: 346.48698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C(=O)NCC2CC[NH+](CC2)C(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C(=O)NCC2CC[NH+](CC2)C(C)C)C

InChI

InChI=1S/C20H31N3O2/c1-13(2)23-8-6-17(7-9-23)12-21-19(24)20(25)22-18-15(4)10-14(3)11-16(18)5/h10-11,13,17H,6-9,12H2,1-5H3,(H,21,24)(H,22,25)/p+1