N-[4-(4-ethoxyphenoxy)phenyl]-1-(phenylmethyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-(4-ethoxyphenoxy)phenyl]-1-(phenylmethyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-benzylsulfonyl-N-[4-(4-ethoxyphenoxy)phenyl]piperidine-4-carboxamide CAS Name: N-[4-(4-ethoxyphenoxy)phenyl]-1-(phenylmethyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: 1-benzylsulfonyl-N-[4-(4-ethoxyphenoxy)phenyl]piperidine-4-carboxamide Traditional Name: 1-benzylsulfonyl-N-[4-(4-ethoxyphenoxy)phenyl]isonipecotamide Formula: C27H30N2O5S MolecularWeight: 494.6025

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C27H30N2O5S/c1-2-33-24-12-14-26(15-13-24)34-25-10-8-23(9-11-25)28-27(30)22-16-18-29(19-17-22)35(31,32)20-21-6-4-3-5-7-21/h3-15,22H,2,16-20H2,1H3,(H,28,30)