ethyl 4-methyl-4-tridecyl-piperazin-4-ium-1-carboxylate

Systemtic Name: ethyl 4-methyl-4-tridecyl-piperazin-4-ium-1-carboxylate Openeye Name: ethyl 4-methyl-4-tridecyl-piperazin-4-ium-1-carboxylate CAS Name: 4-methyl-4-tridecyl-1-piperazin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-4-tridecylpiperazin-4-ium-1-carboxylate Traditional Name: 4-methyl-4-tridecyl-piperazin-4-ium-1-carboxylic acid ethyl ester Formula: C21H43N2O2+ MolecularWeight: 355.57832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H43N2O2/c1-4-6-7-8-9-10-11-12-13-14-15-18-23(3)19-16-22(17-20-23)21(24)25-5-2/h4-20H2,1-3H3/q+1