dimethyl-[(1S)-1-phenyl-2-[3-[[(E)-2-phenylethenyl]sulfonylamino]propanoylamino]ethyl]azanium

Systemtic Name: dimethyl-[(1S)-1-phenyl-2-[3-[[(E)-2-phenylethenyl]sulfonylamino]propanoylamino]ethyl]azanium Openeye Name: dimethyl-[(1S)-1-phenyl-2-[3-[[(E)-styryl]sulfonylamino]propanoylamino]ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[1-oxo-3-[[(E)-2-phenylethenyl]sulfonylamino]propyl]amino]-1-phenylethyl]ammonium IUPAC Name: dimethyl-[(1S)-1-phenyl-2-[3-[[(E)-2-phenylethenyl]sulfonylamino]propanoylamino]ethyl]azanium Traditional Name: dimethyl-[(1S)-1-phenyl-2-[3-[[(E)-styryl]sulfonylamino]propanoylamino]ethyl]ammonium Formula: C21H28N3O3S+ MolecularWeight: 402.53032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)CCNS(=O)(=O)C=CC1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)CCNS(=O)(=O)/C=C/C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C21H27N3O3S/c1-24(2)20(19-11-7-4-8-12-19)17-22-21(25)13-15-23-28(26,27)16-14-18-9-5-3-6-10-18/h3-12,14,16,20,23H,13,15,17H2,1-2H3,(H,22,25)/p+1/b16-14+/t20-/m1/s1