2-(4-butylsulfonylpiperazin-1-yl)benzoic acid

Systemtic Name: 2-(4-butylsulfonylpiperazin-1-yl)benzoic acid Openeye Name: 2-(4-butylsulfonylpiperazin-1-yl)benzoic acid CAS Name: 2-(4-butylsulfonyl-1-piperazinyl)benzoic acid IUPAC Name: 2-(4-butylsulfonylpiperazin-1-yl)benzoic acid Traditional Name: 2-(4-butylsulfonylpiperazino)benzoic acid Formula: C15H22N2O4S MolecularWeight: 326.41118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCN(CC1)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CCCCS(=O)(=O)N1CCN(CC1)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C15H22N2O4S/c1-2-3-12-22(20,21)17-10-8-16(9-11-17)14-7-5-4-6-13(14)15(18)19/h4-7H,2-3,8-12H2,1H3,(H,18,19)