4-methoxy-N-[(2S)-1-oxidanylidene-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)propan-2-yl]benzenesulfonamide

Systemtic Name: 4-methoxy-N-[(2S)-1-oxidanylidene-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)propan-2-yl]benzenesulfonamide Openeye Name: 4-methoxy-N-[(1S)-1-methyl-2-oxo-2-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethyl]benzenesulfonamide CAS Name: 4-methoxy-N-[(2S)-1-oxo-1-[4-(4-pyridin-1-iumyl)-1-piperazinyl]propan-2-yl]benzenesulfonamide IUPAC Name: 4-methoxy-N-[(2S)-1-oxo-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)propan-2-yl]benzenesulfonamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-(4-pyridin-1-ium-4-ylpiperazino)ethyl]-4-methoxy-benzenesulfonamide Formula: C19H25N4O4S+ MolecularWeight: 405.4912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=[NH+]C=C2)NS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

C[C@@H](C(=O)N1CCN(CC1)C2=CC=[NH+]C=C2)NS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H24N4O4S/c1-15(21-28(25,26)18-5-3-17(27-2)4-6-18)19(24)23-13-11-22(12-14-23)16-7-9-20-10-8-16/h3-10,15,21H,11-14H2,1-2H3/p+1/t15-/m0/s1