N3-cyclopropyl-N1-[3-(pyridin-2-ylmethoxy)phenyl]benzene-1,3-disulfonamide

Systemtic Name: N3-cyclopropyl-N1-[3-(pyridin-2-ylmethoxy)phenyl]benzene-1,3-disulfonamide Openeye Name: N3-cyclopropyl-N1-[3-(2-pyridylmethoxy)phenyl]benzene-1,3-disulfonamide CAS Name: N3-cyclopropyl-N1-[3-(2-pyridinylmethoxy)phenyl]benzene-1,3-disulfonamide IUPAC Name: 3-N-cyclopropyl-1-N-[3-(pyridin-2-ylmethoxy)phenyl]benzene-1,3-disulfonamide Traditional Name: N'-cyclopropyl-N-[3-(2-pyridylmethoxy)phenyl]benzene-1,3-disulfonamide Formula: C21H21N3O5S2 MolecularWeight: 459.53854

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)NC3=CC(=CC=C3)OCC4=CC=CC=N4

Isomeric SMILES

C1CC1NS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)NC3=CC(=CC=C3)OCC4=CC=CC=N4

InChI

InChI=1S/C21H21N3O5S2/c25-30(26,23-16-10-11-16)20-8-4-9-21(14-20)31(27,28)24-17-6-3-7-19(13-17)29-15-18-5-1-2-12-22-18/h1-9,12-14,16,23-24H,10-11,15H2