4-(4-methylphenyl)sulfonyl-5-oxidanyl-1-(triphenyl-$l^{5}-phosphanylidene)hexan-2-one

Systemtic Name: 4-(4-methylphenyl)sulfonyl-5-oxidanyl-1-(triphenyl-$l^{5}-phosphanylidene)hexan-2-one Openeye Name: 5-hydroxy-4-(p-tolylsulfonyl)-1-(triphenyl-$l^{5}-phosphanylidene)hexan-2-one CAS Name: 5-hydroxy-4-(4-methylphenyl)sulfonyl-1-triphenylphosphoranylidene-2-hexanone IUPAC Name: 5-hydroxy-4-(4-methylphenyl)sulfonyl-1-(triphenyl-$l^{5}-phosphanylidene)hexan-2-one Traditional Name: 5-hydroxy-4-tosyl-1-triphenylphosphoranylidene-hexan-2-one Formula: C31H31O4PS MolecularWeight: 530.614201

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CC(=O)C=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(C)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CC(=O)C=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(C)O

InChI

InChI=1S/C31H31O4PS/c1-24-18-20-30(21-19-24)37(34,35)31(25(2)32)22-26(33)23-36(27-12-6-3-7-13-27,28-14-8-4-9-15-28)29-16-10-5-11-17-29/h3-21,23,25,31-32H,22H2,1-2H3