ethyl 1-[2-[methylsulfonyl-(4-phenoxyphenyl)amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[methylsulfonyl-(4-phenoxyphenyl)amino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(N-methylsulfonyl-4-phenoxy-anilino)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(N-methylsulfonyl-4-phenoxyanilino)-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(N-methylsulfonyl-4-phenoxyanilino)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(N-mesyl-4-phenoxy-anilino)acetyl]isonipecotic acid ethyl ester Formula: C23H28N2O6S MolecularWeight: 460.54322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CN(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CN(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C23H28N2O6S/c1-3-30-23(27)18-13-15-24(16-14-18)22(26)17-25(32(2,28)29)19-9-11-21(12-10-19)31-20-7-5-4-6-8-20/h4-12,18H,3,13-17H2,1-2H3