[(Z)-1-oxidanyl-1-oxidanylidene-oct-2-en-3-yl]-diphenyl-(3-sulfophenyl)phosphanium

Systemtic Name: [(Z)-1-oxidanyl-1-oxidanylidene-oct-2-en-3-yl]-diphenyl-(3-sulfophenyl)phosphanium Openeye Name: [(1Z)-1-(2-hydroxy-2-oxo-ethylidene)hexyl]-diphenyl-(3-sulfophenyl)phosphonium CAS Name: [(Z)-1-hydroxy-1-oxooct-2-en-3-yl]-diphenyl-(3-sulfophenyl)phosphonium IUPAC Name: [(Z)-1-hydroxy-1-oxooct-2-en-3-yl]-diphenyl-(3-sulfophenyl)phosphanium Traditional Name: [(Z)-1-amyl-3-hydroxy-3-keto-prop-1-enyl]-diphenyl-(3-sulfophenyl)phosphonium Formula: C26H28O5PS+ MolecularWeight: 483.536281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=CC(=O)O)[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)O

Isomeric SMILES

CCCCC/C(=C/C(=O)O)/[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)O

InChI

InChI=1S/C26H27O5PS/c1-2-3-6-16-24(20-26(27)28)32(21-12-7-4-8-13-21,22-14-9-5-10-15-22)23-17-11-18-25(19-23)33(29,30)31/h4-5,7-15,17-20H,2-3,6,16H2,1H3,(H-,27,28,29,30,31)/p+1/b24-20-