(2-oxidanylideneoxolan-3-yl) 3-(4-phenylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: (2-oxidanylideneoxolan-3-yl) 3-(4-phenylpiperazin-1-yl)sulfonylbenzoate Openeye Name: (2-oxotetrahydrofuran-3-yl) 3-(4-phenylpiperazin-1-yl)sulfonylbenzoate CAS Name: 3-[(4-phenyl-1-piperazinyl)sulfonyl]benzoic acid (2-oxo-3-oxolanyl) ester IUPAC Name: (2-oxooxolan-3-yl) 3-(4-phenylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 3-(4-phenylpiperazino)sulfonylbenzoic acid (2-ketotetrahydrofuran-3-yl) ester Formula: C21H22N2O6S MolecularWeight: 430.47418

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1COC(=O)C1OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N2O6S/c24-20(29-19-9-14-28-21(19)25)16-5-4-8-18(15-16)30(26,27)23-12-10-22(11-13-23)17-6-2-1-3-7-17/h1-8,15,19H,9-14H2