2-(4-ethylpiperazin-4-ium-1-yl)carbonylcyclohexene-1-carboxylate

Systemtic Name: 2-(4-ethylpiperazin-4-ium-1-yl)carbonylcyclohexene-1-carboxylate Openeye Name: 2-(4-ethylpiperazin-4-ium-1-carbonyl)cyclohexene-1-carboxylate CAS Name: 2-[(4-ethyl-1-piperazin-4-iumyl)-oxomethyl]-1-cyclohexenecarboxylate IUPAC Name: 2-(4-ethylpiperazin-4-ium-1-carbonyl)cyclohexene-1-carboxylate Traditional Name: 2-(4-ethylpiperazin-4-ium-1-carbonyl)cyclohexene-1-carboxylate Formula: C14H22N2O3 MolecularWeight: 266.33608

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=C(CCCC2)C(=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=C(CCCC2)C(=O)[O-]

InChI

InChI=1S/C14H22N2O3/c1-2-15-7-9-16(10-8-15)13(17)11-5-3-4-6-12(11)14(18)19/h2-10H2,1H3,(H,18,19)