5-methoxy-1-(4-phenylmethoxyphenyl)sulfonyl-piperidine-2-carboxylic acid

Systemtic Name: 5-methoxy-1-(4-phenylmethoxyphenyl)sulfonyl-piperidine-2-carboxylic acid Openeye Name: 1-(4-benzyloxyphenyl)sulfonyl-5-methoxy-piperidine-2-carboxylic acid CAS Name: 5-methoxy-1-(4-phenylmethoxyphenyl)sulfonyl-2-piperidinecarboxylic acid IUPAC Name: 5-methoxy-1-(4-phenylmethoxyphenyl)sulfonylpiperidine-2-carboxylic acid Traditional Name: 1-(4-benzoxyphenyl)sulfonyl-5-methoxy-pipecolinic acid Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCC(N(C1)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

COC1CCC(N(C1)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H23NO6S/c1-26-17-9-12-19(20(22)23)21(13-17)28(24,25)18-10-7-16(8-11-18)27-14-15-5-3-2-4-6-15/h2-8,10-11,17,19H,9,12-14H2,1H3,(H,22,23)