N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(2,3-dihydrobenzofuran-2-ylmethyl)-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-(2,3-dihydrobenzofuran-2-ylmethyl)-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(coumaran-2-ylmethyl)-1-(3-pyridylsulfonyl)isonipecotamide Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2CC3=CC=CC=C3O2)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NCC2CC3=CC=CC=C3O2)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C20H23N3O4S/c24-20(22-13-17-12-16-4-1-2-6-19(16)27-17)15-7-10-23(11-8-15)28(25,26)18-5-3-9-21-14-18/h1-6,9,14-15,17H,7-8,10-13H2,(H,22,24)