dimethyl-[1-[[[3-(propylsulfonylamino)phenyl]carbonylamino]methyl]cycloheptyl]azanium

Systemtic Name: dimethyl-[1-[[[3-(propylsulfonylamino)phenyl]carbonylamino]methyl]cycloheptyl]azanium Openeye Name: dimethyl-[1-[[[3-(propylsulfonylamino)benzoyl]amino]methyl]cycloheptyl]ammonium CAS Name: dimethyl-[1-[[[oxo-[3-(propylsulfonylamino)phenyl]methyl]amino]methyl]cycloheptyl]ammonium IUPAC Name: dimethyl-[1-[[[3-(propylsulfonylamino)benzoyl]amino]methyl]cycloheptyl]azanium Traditional Name: dimethyl-[1-[[[3-(propylsulfonylamino)benzoyl]amino]methyl]cycloheptyl]ammonium Formula: C20H34N3O3S+ MolecularWeight: 396.56726

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)NC1=CC=CC(=C1)C(=O)NCC2(CCCCCC2)[NH+](C)C

Isomeric SMILES

CCCS(=O)(=O)NC1=CC=CC(=C1)C(=O)NCC2(CCCCCC2)[NH+](C)C

InChI

InChI=1S/C20H33N3O3S/c1-4-14-27(25,26)22-18-11-9-10-17(15-18)19(24)21-16-20(23(2)3)12-7-5-6-8-13-20/h9-11,15,22H,4-8,12-14,16H2,1-3H3,(H,21,24)/p+1