3-[4-(phenylmethyl)piperidin-1-yl]propane-1-sulfonic acid

Systemtic Name: 3-[4-(phenylmethyl)piperidin-1-yl]propane-1-sulfonic acid Openeye Name: 3-(4-benzyl-1-piperidyl)propane-1-sulfonic acid CAS Name: 3-[4-(phenylmethyl)-1-piperidinyl]-1-propanesulfonic acid IUPAC Name: 3-(4-benzylpiperidin-1-yl)propane-1-sulfonic acid Traditional Name: 3-(4-benzylpiperidino)propane-1-sulfonic acid Formula: C15H23NO3S MolecularWeight: 297.41302

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CCCS(=O)(=O)O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CCCS(=O)(=O)O

InChI

InChI=1S/C15H23NO3S/c17-20(18,19)12-4-9-16-10-7-15(8-11-16)13-14-5-2-1-3-6-14/h1-3,5-6,15H,4,7-13H2,(H,17,18,19)