2-(4-hexanoylpiperazin-1-yl)ethanoic acid

Systemtic Name: 2-(4-hexanoylpiperazin-1-yl)ethanoic acid Openeye Name: 2-(4-hexanoylpiperazin-1-yl)acetic acid CAS Name: 2-[4-(1-oxohexyl)-1-piperazinyl]acetic acid IUPAC Name: 2-(4-hexanoylpiperazin-1-yl)acetic acid Traditional Name: 2-(4-caproylpiperazino)acetic acid Formula: C12H22N2O3 MolecularWeight: 242.31468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1CCN(CC1)CC(=O)O

Isomeric SMILES

CCCCCC(=O)N1CCN(CC1)CC(=O)O

InChI

InChI=1S/C12H22N2O3/c1-2-3-4-5-11(15)14-8-6-13(7-9-14)10-12(16)17/h2-10H2,1H3,(H,16,17)