ethyl 4-(2-ethoxy-2-oxidanylidene-ethyl)-4-octyl-piperazin-4-ium-1-carboxylate

Systemtic Name: ethyl 4-(2-ethoxy-2-oxidanylidene-ethyl)-4-octyl-piperazin-4-ium-1-carboxylate Openeye Name: ethyl 4-(2-ethoxy-2-oxo-ethyl)-4-octyl-piperazin-4-ium-1-carboxylate CAS Name: 4-(2-ethoxy-2-oxoethyl)-4-octyl-1-piperazin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-ethoxy-2-oxoethyl)-4-octylpiperazin-4-ium-1-carboxylate Traditional Name: 4-(2-ethoxy-2-keto-ethyl)-4-octyl-piperazin-4-ium-1-carboxylic acid ethyl ester Formula: C19H37N2O4+ MolecularWeight: 357.50808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+]1(CCN(CC1)C(=O)OCC)CC(=O)OCC

Isomeric SMILES

CCCCCCCC[N+]1(CCN(CC1)C(=O)OCC)CC(=O)OCC

InChI

InChI=1S/C19H37N2O4/c1-4-7-8-9-10-11-14-21(17-18(22)24-5-2)15-12-20(13-16-21)19(23)25-6-3/h4-17H2,1-3H3/q+1