4-[4-[(E)-5-phenylmethoxypent-1-enyl]piperidin-1-yl]sulfonyloxane-4-carboxylic acid

Systemtic Name: 4-[4-[(E)-5-phenylmethoxypent-1-enyl]piperidin-1-yl]sulfonyloxane-4-carboxylic acid Openeye Name: 4-[[4-[(E)-5-benzyloxypent-1-enyl]-1-piperidyl]sulfonyl]tetrahydropyran-4-carboxylic acid CAS Name: 4-[[4-[(E)-5-phenylmethoxypent-1-enyl]-1-piperidinyl]sulfonyl]-4-oxanecarboxylic acid IUPAC Name: 4-[4-[(E)-5-phenylmethoxypent-1-enyl]piperidin-1-yl]sulfonyloxane-4-carboxylic acid Traditional Name: 4-[4-[(E)-5-benzoxypent-1-enyl]piperidino]sulfonyltetrahydropyran-4-carboxylic acid Formula: C23H33NO6S MolecularWeight: 451.57622

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C=CCCCOCC2=CC=CC=C2)S(=O)(=O)C3(CCOCC3)C(=O)O

Isomeric SMILES

C1CN(CCC1/C=C/CCCOCC2=CC=CC=C2)S(=O)(=O)C3(CCOCC3)C(=O)O

InChI

InChI=1S/C23H33NO6S/c25-22(26)23(12-17-29-18-13-23)31(27,28)24-14-10-20(11-15-24)7-5-2-6-16-30-19-21-8-3-1-4-9-21/h1,3-5,7-9,20H,2,6,10-19H2,(H,25,26)/b7-5+