N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[[1-(4-pyridylmethyl)-4-piperidyl]methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[[1-(pyridin-4-ylmethyl)-4-piperidinyl]methyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[[1-(4-pyridylmethyl)-4-piperidyl]methyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNS(=O)(=O)C2=CC3=C(C=C2)OCCO3)CC4=CC=NC=C4

Isomeric SMILES

C1CN(CCC1CNS(=O)(=O)C2=CC3=C(C=C2)OCCO3)CC4=CC=NC=C4

InChI

InChI=1S/C20H25N3O4S/c24-28(25,18-1-2-19-20(13-18)27-12-11-26-19)22-14-16-5-9-23(10-6-16)15-17-3-7-21-8-4-17/h1-4,7-8,13,16,22H,5-6,9-12,14-15H2