(3R)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-3H-2-benzofuran-1-one

Systemtic Name: (3R)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-3H-2-benzofuran-1-one Openeye Name: (3R)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-3H-isobenzofuran-1-one CAS Name: (3R)-3-[4-(2-hydroxyethyl)-1-piperazine-1,4-diiumyl]-3H-isobenzofuran-1-one IUPAC Name: (3R)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-3H-2-benzofuran-1-one Traditional Name: (3R)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]phthalide Formula: C14H20N2O3+2 MolecularWeight: 264.3202

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CCO)C2C3=CC=CC=C3C(=O)O2

Isomeric SMILES

C1C[NH+](CC[NH+]1CCO)[C@H]2C3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C14H18N2O3/c17-10-9-15-5-7-16(8-6-15)13-11-3-1-2-4-12(11)14(18)19-13/h1-4,13,17H,5-10H2/p+2/t13-/m1/s1