2-(cyclohexen-1-yl)prop-2-enyl-triphenyl-phosphanium; 4-methylbenzenesulfonate

Systemtic Name: 2-(cyclohexen-1-yl)prop-2-enyl-triphenyl-phosphanium; 4-methylbenzenesulfonate Openeye Name: 2-(cyclohexen-1-yl)allyl-triphenyl-phosphonium; 4-methylbenzenesulfonate CAS Name: 2-(1-cyclohexenyl)prop-2-enyl-triphenylphosphonium; 4-methylbenzenesulfonate IUPAC Name: 2-(cyclohexen-1-yl)prop-2-enyl-triphenylphosphanium; 4-methylbenzenesulfonate Traditional Name: 2-(cyclohexen-1-yl)allyl-triphenyl-phosphonium tosylate Formula: C34H35O3PS MolecularWeight: 554.678661

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C=C(C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C=C(C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CCCCC4

InChI

InChI=1S/C27H28P.C7H8O3S/c1-23(24-14-6-2-7-15-24)22-28(25-16-8-3-9-17-25,26-18-10-4-11-19-26)27-20-12-5-13-21-27;1-6-2-4-7(5-3-6)11(8,9)10/h3-5,8-14,16-21H,1-2,6-7,15,22H2;2-5H,1H3,(H,8,9,10)/q+1;/p-1