2-(4-phenethylsulfonylpiperazin-1-yl)ethanoic acid

Systemtic Name: 2-(4-phenethylsulfonylpiperazin-1-yl)ethanoic acid Openeye Name: 2-(4-phenethylsulfonylpiperazin-1-yl)acetic acid CAS Name: 2-(4-phenethylsulfonyl-1-piperazinyl)acetic acid IUPAC Name: 2-(4-phenethylsulfonylpiperazin-1-yl)acetic acid Traditional Name: 2-(4-phenethylsulfonylpiperazino)acetic acid Formula: C14H20N2O4S MolecularWeight: 312.3846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)S(=O)(=O)CCC2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1CC(=O)O)S(=O)(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C14H20N2O4S/c17-14(18)12-15-7-9-16(10-8-15)21(19,20)11-6-13-4-2-1-3-5-13/h1-5H,6-12H2,(H,17,18)