3-(4-chlorophenyl)prop-2-ynyl-(4-methoxyphenyl)sulfonyl-oxidanyl-[(2S)-1-oxidanyl-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: 3-(4-chlorophenyl)prop-2-ynyl-(4-methoxyphenyl)sulfonyl-oxidanyl-[(2S)-1-oxidanyl-1-oxidanylidene-propan-2-yl]azanium Openeye Name: 3-(4-chlorophenyl)prop-2-ynyl-hydroxy-[(1S)-2-hydroxy-1-methyl-2-oxo-ethyl]-(4-methoxyphenyl)sulfonyl-ammonium CAS Name: 3-(4-chlorophenyl)prop-2-ynyl-hydroxy-[(2S)-1-hydroxy-1-oxopropan-2-yl]-(4-methoxyphenyl)sulfonylammonium IUPAC Name: 3-(4-chlorophenyl)prop-2-ynyl-hydroxy-[(2S)-1-hydroxy-1-oxopropan-2-yl]-(4-methoxyphenyl)sulfonylazanium Traditional Name: 3-(4-chlorophenyl)prop-2-ynyl-hydroxy-[(1S)-2-hydroxy-2-keto-1-methyl-ethyl]-(4-methoxyphenyl)sulfonyl-ammonium Formula: C19H19ClNO6S+ MolecularWeight: 424.87526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)[N+](CC#CC1=CC=C(C=C1)Cl)(O)S(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

C[C@@H](C(=O)O)[N+](CC#CC1=CC=C(C=C1)Cl)(O)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C19H18ClNO6S/c1-14(19(22)23)21(24,13-3-4-15-5-7-16(20)8-6-15)28(25,26)18-11-9-17(27-2)10-12-18/h5-12,14,24H,13H2,1-2H3/p+1/t14-,21?/m0/s1