(3R)-3-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one

Systemtic Name: (3R)-3-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one Openeye Name: (3R)-3-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-3H-isobenzofuran-1-one CAS Name: (3R)-3-[2-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-3H-isobenzofuran-1-one IUPAC Name: (3R)-3-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-3H-2-benzofuran-1-one Traditional Name: (3R)-3-[2-[4-(3-fluorophenyl)sulfonylpiperazino]-2-keto-ethyl]phthalide Formula: C20H19FN2O5S MolecularWeight: 418.438663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2C3=CC=CC=C3C(=O)O2)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

C1CN(CCN1C(=O)C[C@@H]2C3=CC=CC=C3C(=O)O2)S(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C20H19FN2O5S/c21-14-4-3-5-15(12-14)29(26,27)23-10-8-22(9-11-23)19(24)13-18-16-6-1-2-7-17(16)20(25)28-18/h1-7,12,18H,8-11,13H2/t18-/m1/s1