2-[4-(phenylmethoxymethyl)piperidin-1-yl]sulfonylethanoic acid

Systemtic Name: 2-[4-(phenylmethoxymethyl)piperidin-1-yl]sulfonylethanoic acid Openeye Name: 2-[[4-(benzyloxymethyl)-1-piperidyl]sulfonyl]acetic acid CAS Name: 2-[[4-(phenylmethoxymethyl)-1-piperidinyl]sulfonyl]acetic acid IUPAC Name: 2-[4-(phenylmethoxymethyl)piperidin-1-yl]sulfonylacetic acid Traditional Name: 2-[4-(benzoxymethyl)piperidino]sulfonylacetic acid Formula: C15H21NO5S MolecularWeight: 327.39594

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1COCC2=CC=CC=C2)S(=O)(=O)CC(=O)O

Isomeric SMILES

C1CN(CCC1COCC2=CC=CC=C2)S(=O)(=O)CC(=O)O

InChI

InChI=1S/C15H21NO5S/c17-15(18)12-22(19,20)16-8-6-14(7-9-16)11-21-10-13-4-2-1-3-5-13/h1-5,14H,6-12H2,(H,17,18)