N-[4-(4-ethoxyphenoxy)phenyl]-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[4-(4-ethoxyphenoxy)phenyl]-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[4-(4-ethoxyphenoxy)phenyl]-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: N-[4-(4-ethoxyphenoxy)phenyl]-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[4-(4-ethoxyphenoxy)phenyl]-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: N-[4-(4-ethoxyphenoxy)phenyl]-1-mesyl-nipecotamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C3CCCN(C3)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C3CCCN(C3)S(=O)(=O)C

InChI

InChI=1S/C21H26N2O5S/c1-3-27-18-10-12-20(13-11-18)28-19-8-6-17(7-9-19)22-21(24)16-5-4-14-23(15-16)29(2,25)26/h6-13,16H,3-5,14-15H2,1-2H3,(H,22,24)