1-[2-[methylsulfonyl-(4-phenylmethoxyphenyl)amino]ethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[methylsulfonyl-(4-phenylmethoxyphenyl)amino]ethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-(4-benzyloxy-N-methylsulfonyl-anilino)acetyl]piperidine-4-carboxamide CAS Name: 1-[2-(N-methylsulfonyl-4-phenylmethoxyanilino)-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(N-methylsulfonyl-4-phenylmethoxyanilino)acetyl]piperidine-4-carboxamide Traditional Name: 1-[2-(4-benzoxy-N-mesyl-anilino)acetyl]isonipecotamide Formula: C22H27N3O5S MolecularWeight: 445.53188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)N1CCC(CC1)C(=O)N)C2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)N(CC(=O)N1CCC(CC1)C(=O)N)C2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O5S/c1-31(28,29)25(15-21(26)24-13-11-18(12-14-24)22(23)27)19-7-9-20(10-8-19)30-16-17-5-3-2-4-6-17/h2-10,18H,11-16H2,1H3,(H2,23,27)