4-methoxy-N-[3-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-oxidanylidene-propyl]benzenesulfonamide

Systemtic Name: 4-methoxy-N-[3-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-oxidanylidene-propyl]benzenesulfonamide Openeye Name: 4-methoxy-N-[3-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-oxo-propyl]benzenesulfonamide CAS Name: 4-methoxy-N-[3-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-oxopropyl]benzenesulfonamide IUPAC Name: 4-methoxy-N-[3-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-oxopropyl]benzenesulfonamide Traditional Name: N-[3-keto-3-(4-methyl-1,4-diazepan-4-ium-1-yl)propyl]-4-methoxy-benzenesulfonamide Formula: C16H26N3O4S+ MolecularWeight: 356.46034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(=O)CCNS(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

C[NH+]1CCCN(CC1)C(=O)CCNS(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C16H25N3O4S/c1-18-10-3-11-19(13-12-18)16(20)8-9-17-24(21,22)15-6-4-14(23-2)5-7-15/h4-7,17H,3,8-13H2,1-2H3/p+1