[(R)-[5-bromanyl-2-(phenylsulfonylamino)phenyl]-phenyl-methyl]-(2-methoxy-2-oxidanylidene-ethyl)azanium

Systemtic Name: [(R)-[5-bromanyl-2-(phenylsulfonylamino)phenyl]-phenyl-methyl]-(2-methoxy-2-oxidanylidene-ethyl)azanium Openeye Name: [(R)-[2-(benzenesulfonamido)-5-bromo-phenyl]-phenyl-methyl]-(2-methoxy-2-oxo-ethyl)ammonium CAS Name: [(R)-[2-(benzenesulfonamido)-5-bromophenyl]-phenylmethyl]-(2-methoxy-2-oxoethyl)ammonium IUPAC Name: [(R)-[2-(benzenesulfonamido)-5-bromophenyl]-phenylmethyl]-(2-methoxy-2-oxoethyl)azanium Traditional Name: [(R)-[2-(benzenesulfonamido)-5-bromo-phenyl]-phenyl-methyl]-(2-keto-2-methoxy-ethyl)ammonium Formula: C22H22BrN2O4S+ MolecularWeight: 490.39008

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C[NH2+]C(C1=CC=CC=C1)C2=C(C=CC(=C2)Br)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C[NH2+][C@H](C1=CC=CC=C1)C2=C(C=CC(=C2)Br)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H21BrN2O4S/c1-29-21(26)15-24-22(16-8-4-2-5-9-16)19-14-17(23)12-13-20(19)25-30(27,28)18-10-6-3-7-11-18/h2-14,22,24-25H,15H2,1H3/p+1/t22-/m1/s1