2-[4-[2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl]phenyl]ethanoic acid Openeye Name: 2-[4-[2-[4-(benzenesulfonyl)piperazin-1-yl]ethyl]phenyl]acetic acid CAS Name: 2-[4-[2-[4-(benzenesulfonyl)-1-piperazinyl]ethyl]phenyl]acetic acid IUPAC Name: 2-[4-[2-[4-(benzenesulfonyl)piperazin-1-yl]ethyl]phenyl]acetic acid Traditional Name: 2-[4-[2-(4-besylpiperazino)ethyl]phenyl]acetic acid Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=C(C=C2)CC(=O)O)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCC2=CC=C(C=C2)CC(=O)O)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H24N2O4S/c23-20(24)16-18-8-6-17(7-9-18)10-11-21-12-14-22(15-13-21)27(25,26)19-4-2-1-3-5-19/h1-9H,10-16H2,(H,23,24)