[4-(phenylsulfonyl)phenyl] bis[3,6,8-tris(2,3-dimethylbutan-2-yl)naphthalen-2-yl] phosphite

Systemtic Name: [4-(phenylsulfonyl)phenyl] bis[3,6,8-tris(2,3-dimethylbutan-2-yl)naphthalen-2-yl] phosphite Openeye Name: [4-(benzenesulfonyl)phenyl] bis[3,6,8-tris(1,1,2-trimethylpropyl)-2-naphthyl] phosphite CAS Name: phosphorous acid [4-(benzenesulfonyl)phenyl] bis[3,6,8-tris(2,3-dimethylbutan-2-yl)-2-naphthalenyl] ester IUPAC Name: [4-(benzenesulfonyl)phenyl] bis[3,6,8-tris(2,3-dimethylbutan-2-yl)naphthalen-2-yl] phosphite Traditional Name: phosphorous acid (4-besylphenyl) bis(3,6,8-trithexyl-2-naphthyl) ester Formula: C68H95O5PS MolecularWeight: 1055.517661

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C)C1=CC(=C2C=C(C(=CC2=C1)C(C)(C)C(C)C)OP(OC3=CC=C(C=C3)S(=O)(=O)C4=CC=CC=C4)OC5=CC6=C(C=C(C=C6C=C5C(C)(C)C(C)C)C(C)(C)C(C)C)C(C)(C)C(C)C)C(C)(C)C(C)C

Isomeric SMILES

CC(C)C(C)(C)C1=CC(=C2C=C(C(=CC2=C1)C(C)(C)C(C)C)OP(OC3=CC=C(C=C3)S(=O)(=O)C4=CC=CC=C4)OC5=CC6=C(C=C(C=C6C=C5C(C)(C)C(C)C)C(C)(C)C(C)C)C(C)(C)C(C)C)C(C)(C)C(C)C

InChI

InChI=1S/C68H95O5PS/c1-42(2)63(13,14)50-34-48-36-59(67(21,22)46(9)10)61(40-55(48)57(38-50)65(17,18)44(5)6)72-74(71-52-30-32-54(33-31-52)75(69,70)53-28-26-25-27-29-53)73-62-41-56-49(37-60(62)68(23,24)47(11)12)35-51(64(15,16)43(3)4)39-58(56)66(19,20)45(7)8/h25-47H,1-24H3