2-[4-(phenylmethyl)piperazin-1-yl]hexanoic acid

Systemtic Name: 2-[4-(phenylmethyl)piperazin-1-yl]hexanoic acid Openeye Name: 2-(4-benzylpiperazin-1-yl)hexanoic acid CAS Name: 2-[4-(phenylmethyl)-1-piperazinyl]hexanoic acid IUPAC Name: 2-(4-benzylpiperazin-1-yl)hexanoic acid Traditional Name: 2-(4-benzylpiperazino)hexanoic acid Formula: C17H26N2O2 MolecularWeight: 290.40054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)N1CCN(CC1)CC2=CC=CC=C2

Isomeric SMILES

CCCCC(C(=O)O)N1CCN(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C17H26N2O2/c1-2-3-9-16(17(20)21)19-12-10-18(11-13-19)14-15-7-5-4-6-8-15/h4-8,16H,2-3,9-14H2,1H3,(H,20,21)