N-[2-(3-methylphenoxy)phenyl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(3-methylphenoxy)phenyl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(3-methylphenoxy)phenyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(3-methylphenoxy)phenyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(3-methylphenoxy)phenyl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: 1-mesyl-N-[2-(3-methylphenoxy)phenyl]isonipecotamide Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC=CC=C2NC(=O)C3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC=CC=C2NC(=O)C3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C20H24N2O4S/c1-15-6-5-7-17(14-15)26-19-9-4-3-8-18(19)21-20(23)16-10-12-22(13-11-16)27(2,24)25/h3-9,14,16H,10-13H2,1-2H3,(H,21,23)