N-[4-[(7-propan-2-yl-3-aza-7-azoniabicyclo[3.3.1]nonan-3-yl)carbonyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[(7-propan-2-yl-3-aza-7-azoniabicyclo[3.3.1]nonan-3-yl)carbonyl]phenyl]methanesulfonamide Openeye Name: N-[4-(7-isopropyl-3-aza-7-azoniabicyclo[3.3.1]nonane-3-carbonyl)phenyl]methanesulfonamide CAS Name: N-[4-[oxo-(7-propan-2-yl-3-aza-7-azoniabicyclo[3.3.1]nonan-3-yl)methyl]phenyl]methanesulfonamide IUPAC Name: N-[4-(7-propan-2-yl-3-aza-7-azoniabicyclo[3.3.1]nonane-3-carbonyl)phenyl]methanesulfonamide Traditional Name: N-[4-(7-isopropyl-3-aza-7-azoniabicyclo[3.3.1]nonane-3-carbonyl)phenyl]methanesulfonamide Formula: C18H28N3O3S+ MolecularWeight: 366.49822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CC2CC(C1)CN(C2)C(=O)C3=CC=C(C=C3)NS(=O)(=O)C

Isomeric SMILES

CC(C)[NH+]1CC2CC(C1)CN(C2)C(=O)C3=CC=C(C=C3)NS(=O)(=O)C

InChI

InChI=1S/C18H27N3O3S/c1-13(2)20-9-14-8-15(10-20)12-21(11-14)18(22)16-4-6-17(7-5-16)19-25(3,23)24/h4-7,13-15,19H,8-12H2,1-3H3/p+1