4-(4-methylpiperazin-1-yl)but-2-ynoic acid

Systemtic Name: 4-(4-methylpiperazin-1-yl)but-2-ynoic acid Openeye Name: 4-(4-methylpiperazin-1-yl)but-2-ynoic acid CAS Name: 4-(4-methyl-1-piperazinyl)-2-butynoic acid IUPAC Name: 4-(4-methylpiperazin-1-yl)but-2-ynoic acid Traditional Name: 4-(4-methylpiperazino)but-2-ynoic acid Formula: C9H14N2O2 MolecularWeight: 182.21966

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC#CC(=O)O

Isomeric SMILES

CN1CCN(CC1)CC#CC(=O)O

InChI

InChI=1S/C9H14N2O2/c1-10-5-7-11(8-6-10)4-2-3-9(12)13/h4-8H2,1H3,(H,12,13)