cyclooctyl-[2-[[4-(diethylsulfamoyl)phenyl]methylamino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: cyclooctyl-[2-[[4-(diethylsulfamoyl)phenyl]methylamino]-2-oxidanylidene-ethyl]azanium Openeye Name: cyclooctyl-[2-[[4-(diethylsulfamoyl)phenyl]methylamino]-2-oxo-ethyl]ammonium CAS Name: cyclooctyl-[2-[[4-(diethylsulfamoyl)phenyl]methylamino]-2-oxoethyl]ammonium IUPAC Name: cyclooctyl-[2-[[4-(diethylsulfamoyl)phenyl]methylamino]-2-oxoethyl]azanium Traditional Name: cyclooctyl-[2-[[4-(diethylsulfamoyl)benzyl]amino]-2-keto-ethyl]ammonium Formula: C21H36N3O3S+ MolecularWeight: 410.59384

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CNC(=O)C[NH2+]C2CCCCCCC2

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CNC(=O)C[NH2+]C2CCCCCCC2

InChI

InChI=1S/C21H35N3O3S/c1-3-24(4-2)28(26,27)20-14-12-18(13-15-20)16-23-21(25)17-22-19-10-8-6-5-7-9-11-19/h12-15,19,22H,3-11,16-17H2,1-2H3,(H,23,25)/p+1