1-[1-(4-methyl-2-oxidanylidene-pentanoyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[1-(4-methyl-2-oxidanylidene-pentanoyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[1-(4-methyl-2-oxo-pentanoyl)-4-piperidyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[1-(4-methyl-1,2-dioxopentyl)-4-piperidinyl]-N-[[(2R)-2-oxolanyl]methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[1-(4-methyl-2-oxopentanoyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[1-(2-keto-4-methyl-pentanoyl)-4-piperidyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]piperidin-1-ium-4-carboxamide Formula: C22H38N3O4+ MolecularWeight: 408.55482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C(=O)N1CCC(CC1)[NH+]2CCC(CC2)C(=O)NCC3CCCO3

Isomeric SMILES

CC(C)CC(=O)C(=O)N1CCC(CC1)[NH+]2CCC(CC2)C(=O)NC[C@H]3CCCO3

InChI

InChI=1S/C22H37N3O4/c1-16(2)14-20(26)22(28)25-11-7-18(8-12-25)24-9-5-17(6-10-24)21(27)23-15-19-4-3-13-29-19/h16-19H,3-15H2,1-2H3,(H,23,27)/p+1/t19-/m1/s1