ethyl 4-methyl-4-prop-2-ynyl-piperazin-4-ium-1-carboxylate

Systemtic Name: ethyl 4-methyl-4-prop-2-ynyl-piperazin-4-ium-1-carboxylate Openeye Name: ethyl 4-methyl-4-prop-2-ynyl-piperazin-4-ium-1-carboxylate CAS Name: 4-methyl-4-prop-2-ynyl-1-piperazin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-4-prop-2-ynylpiperazin-4-ium-1-carboxylate Traditional Name: 4-methyl-4-propargyl-piperazin-4-ium-1-carboxylic acid ethyl ester Formula: C11H19N2O2+ MolecularWeight: 211.28076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H19N2O2/c1-4-8-13(3)9-6-12(7-10-13)11(14)15-5-2/h1H,5-10H2,2-3H3/q+1