4-(1-ethylpiperazin-1-ium-1-yl)but-2-ynoic acid

Systemtic Name: 4-(1-ethylpiperazin-1-ium-1-yl)but-2-ynoic acid Openeye Name: 4-(1-ethylpiperazin-1-ium-1-yl)but-2-ynoic acid CAS Name: 4-(1-ethyl-1-piperazin-1-iumyl)-2-butynoic acid IUPAC Name: 4-(1-ethylpiperazin-1-ium-1-yl)but-2-ynoic acid Traditional Name: 4-(1-ethylpiperazin-1-ium-1-yl)but-2-ynoic acid Formula: C10H17N2O2+ MolecularWeight: 197.25418

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CCNCC1)CC#CC(=O)O

Isomeric SMILES

CC[N+]1(CCNCC1)CC#CC(=O)O

InChI

InChI=1S/C10H16N2O2/c1-2-12(7-3-4-10(13)14)8-5-11-6-9-12/h11H,2,5-9H2,1H3/p+1