2-(4-propylsulfonylpiperazin-1-yl)benzoate

Systemtic Name: 2-(4-propylsulfonylpiperazin-1-yl)benzoate Openeye Name: 2-(4-propylsulfonylpiperazin-1-yl)benzoate CAS Name: 2-(4-propylsulfonyl-1-piperazinyl)benzoate IUPAC Name: 2-(4-propylsulfonylpiperazin-1-yl)benzoate Traditional Name: 2-(4-propylsulfonylpiperazino)benzoate Formula: C14H19N2O4S- MolecularWeight: 311.37666

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(CC1)C2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

CCCS(=O)(=O)N1CCN(CC1)C2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C14H20N2O4S/c1-2-11-21(19,20)16-9-7-15(8-10-16)13-6-4-3-5-12(13)14(17)18/h3-6H,2,7-11H2,1H3,(H,17,18)/p-1