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

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(3-pyridylsulfonyl)isonipecotamide Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2COC3=CC=CC=C3O2)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NCC2COC3=CC=CC=C3O2)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C20H23N3O5S/c24-20(22-12-16-14-27-18-5-1-2-6-19(18)28-16)15-7-10-23(11-8-15)29(25,26)17-4-3-9-21-13-17/h1-6,9,13,15-16H,7-8,10-12,14H2,(H,22,24)