N4-cyclopropyl-N1-[[3-(morpholin-4-ylmethyl)phenyl]methyl]benzene-1,4-disulfonamide

Systemtic Name: N4-cyclopropyl-N1-[[3-(morpholin-4-ylmethyl)phenyl]methyl]benzene-1,4-disulfonamide Openeye Name: N4-cyclopropyl-N1-[[3-(morpholinomethyl)phenyl]methyl]benzene-1,4-disulfonamide CAS Name: N4-cyclopropyl-N1-[[3-(4-morpholinylmethyl)phenyl]methyl]benzene-1,4-disulfonamide IUPAC Name: 4-N-cyclopropyl-1-N-[[3-(morpholin-4-ylmethyl)phenyl]methyl]benzene-1,4-disulfonamide Traditional Name: N'-cyclopropyl-N-[3-(morpholinomethyl)benzyl]benzene-1,4-disulfonamide Formula: C21H27N3O5S2 MolecularWeight: 465.58618

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CC(=C3)CN4CCOCC4

Isomeric SMILES

C1CC1NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CC(=C3)CN4CCOCC4

InChI

InChI=1S/C21H27N3O5S2/c25-30(26,20-6-8-21(9-7-20)31(27,28)23-19-4-5-19)22-15-17-2-1-3-18(14-17)16-24-10-12-29-13-11-24/h1-3,6-9,14,19,22-23H,4-5,10-13,15-16H2