1-ethyl-1-[2-(1-methoxycyclohexyl)-2-oxidanylidene-ethanoyl]piperidin-1-ium-2-carboxylic acid

Systemtic Name: 1-ethyl-1-[2-(1-methoxycyclohexyl)-2-oxidanylidene-ethanoyl]piperidin-1-ium-2-carboxylic acid Openeye Name: 1-ethyl-1-[2-(1-methoxycyclohexyl)-2-oxo-acetyl]piperidin-1-ium-2-carboxylic acid CAS Name: 1-ethyl-1-[2-(1-methoxycyclohexyl)-1,2-dioxoethyl]-2-piperidin-1-iumcarboxylic acid IUPAC Name: 1-ethyl-1-[2-(1-methoxycyclohexyl)-2-oxoacetyl]piperidin-1-ium-2-carboxylic acid Traditional Name: 1-ethyl-1-[2-keto-2-(1-methoxycyclohexyl)acetyl]piperidin-1-ium-2-carboxylic acid Formula: C17H28NO5+ MolecularWeight: 326.40792

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CCCCC1C(=O)O)C(=O)C(=O)C2(CCCCC2)OC

Isomeric SMILES

CC[N+]1(CCCCC1C(=O)O)C(=O)C(=O)C2(CCCCC2)OC

InChI

InChI=1S/C17H27NO5/c1-3-18(12-8-5-9-13(18)16(21)22)15(20)14(19)17(23-2)10-6-4-7-11-17/h13H,3-12H2,1-2H3/p+1