N-[2-(4-ethoxyphenoxy)phenyl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(4-ethoxyphenoxy)phenyl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(4-ethoxyphenoxy)phenyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(4-ethoxyphenoxy)phenyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(4-ethoxyphenoxy)phenyl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(4-ethoxyphenoxy)phenyl]-1-mesyl-isonipecotamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=CC=CC=C2NC(=O)C3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=CC=CC=C2NC(=O)C3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C21H26N2O5S/c1-3-27-17-8-10-18(11-9-17)28-20-7-5-4-6-19(20)22-21(24)16-12-14-23(15-13-16)29(2,25)26/h4-11,16H,3,12-15H2,1-2H3,(H,22,24)