ethyl 4-[(E)-2-methylbut-2-enyl]piperazin-4-ium-1-carboxylate

Systemtic Name: ethyl 4-[(E)-2-methylbut-2-enyl]piperazin-4-ium-1-carboxylate Openeye Name: ethyl 4-[(E)-2-methylbut-2-enyl]piperazin-4-ium-1-carboxylate CAS Name: 4-[(E)-2-methylbut-2-enyl]-1-piperazin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-2-methylbut-2-enyl]piperazin-4-ium-1-carboxylate Traditional Name: 4-[(E)-2-methylbut-2-enyl]piperazin-4-ium-1-carboxylic acid ethyl ester Formula: C12H23N2O2+ MolecularWeight: 227.32322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC[NH+](CC1)CC(=CC)C

Isomeric SMILES

CCOC(=O)N1CC[NH+](CC1)C/C(=C/C)/C

InChI

InChI=1S/C12H22N2O2/c1-4-11(3)10-13-6-8-14(9-7-13)12(15)16-5-2/h4H,5-10H2,1-3H3/p+1/b11-4+