methyl 1-[2-[[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate

Systemtic Name: methyl 1-[2-[[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[2-[[2-(tert-butylamino)-2-oxo-ethyl]-methyl-amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-2-oxoethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-[[2-(tert-butylamino)-2-keto-ethyl]-methyl-amino]-2-keto-ethyl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C16H30N3O4+ MolecularWeight: 328.4271

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C)C(=O)C[NH+]1CCC(CC1)C(=O)OC

Isomeric SMILES

CC(C)(C)NC(=O)CN(C)C(=O)C[NH+]1CCC(CC1)C(=O)OC

InChI

InChI=1S/C16H29N3O4/c1-16(2,3)17-13(20)10-18(4)14(21)11-19-8-6-12(7-9-19)15(22)23-5/h12H,6-11H2,1-5H3,(H,17,20)/p+1