N-propan-2-yl-4-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-propan-2-yl-4-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-isopropyl-4-[2-(isopropylamino)pyridin-1-ium-1-carbonyl]benzenesulfonamide CAS Name: 4-[oxo-[2-(propan-2-ylamino)-1-pyridin-1-iumyl]methyl]-N-propan-2-ylbenzenesulfonamide IUPAC Name: N-propan-2-yl-4-[2-(propan-2-ylamino)pyridin-1-ium-1-carbonyl]benzenesulfonamide Traditional Name: N-isopropyl-4-[2-(isopropylamino)pyridin-1-ium-1-carbonyl]benzenesulfonamide Formula: C18H24N3O3S+ MolecularWeight: 362.46646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=CC=CC=[N+]1C(=O)C2=CC=C(C=C2)S(=O)(=O)NC(C)C

Isomeric SMILES

CC(C)NC1=CC=CC=[N+]1C(=O)C2=CC=C(C=C2)S(=O)(=O)NC(C)C

InChI

InChI=1S/C18H23N3O3S/c1-13(2)19-17-7-5-6-12-21(17)18(22)15-8-10-16(11-9-15)25(23,24)20-14(3)4/h5-14,20H,1-4H3/p+1