[(2S)-2-[[4-chloranyl-3-(prop-2-enylsulfamoyl)phenyl]carbonylamino]-2-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(2S)-2-[[4-chloranyl-3-(prop-2-enylsulfamoyl)phenyl]carbonylamino]-2-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(2S)-2-[[3-(allylsulfamoyl)-4-chloro-benzoyl]amino]-2-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(2S)-2-[[[4-chloro-3-(prop-2-enylsulfamoyl)phenyl]-oxomethyl]amino]-2-phenylethyl]-dimethylammonium IUPAC Name: [(2S)-2-[[4-chloro-3-(prop-2-enylsulfamoyl)benzoyl]amino]-2-phenylethyl]-dimethylazanium Traditional Name: [(2S)-2-[[3-(allylsulfamoyl)-4-chloro-benzoyl]amino]-2-phenyl-ethyl]-dimethyl-ammonium Formula: C20H25ClN3O3S+ MolecularWeight: 422.9488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(C1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NCC=C

Isomeric SMILES

C[NH+](C)C[C@H](C1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NCC=C

InChI

InChI=1S/C20H24ClN3O3S/c1-4-12-22-28(26,27)19-13-16(10-11-17(19)21)20(25)23-18(14-24(2)3)15-8-6-5-7-9-15/h4-11,13,18,22H,1,12,14H2,2-3H3,(H,23,25)/p+1/t18-/m1/s1