N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-N-(pyridin-3-ylmethyl)propane-1-sulfonamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-N-(pyridin-3-ylmethyl)propane-1-sulfonamide Openeye Name: N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-N-(3-pyridylmethyl)propane-1-sulfonamide CAS Name: N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-N-(3-pyridinylmethyl)-1-propanesulfonamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-N-(pyridin-3-ylmethyl)propane-1-sulfonamide Traditional Name: N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-N-(3-pyridylmethyl)propane-1-sulfonamide Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N(CC1=CN=CC=C1)C2=CC=C(C=C2)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCS(=O)(=O)N(CC1=CN=CC=C1)C2=CC=C(C=C2)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H22N2O5S/c1-2-12-30(25,26)24(15-17-4-3-11-23-14-17)18-5-7-19(8-6-18)29-20-9-10-21-22(13-20)28-16-27-21/h3-11,13-14H,2,12,15-16H2,1H3