dimethyl 1,9-ditert-butyl-11-phenyl-5H-benzo[d][1,3,2]benzodioxaphosphocine-3,7-dicarboxylate

Systemtic Name: dimethyl 1,9-ditert-butyl-11-phenyl-5H-benzo[d][1,3,2]benzodioxaphosphocine-3,7-dicarboxylate Openeye Name: dimethyl 1,9-ditert-butyl-11-phenyl-5H-benzo[d][1,3,2]benzodioxaphosphocine-3,7-dicarboxylate CAS Name: 1,9-ditert-butyl-11-phenyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-3,7-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1,9-ditert-butyl-11-phenyl-5H-benzo[d][1,3,2]benzodioxaphosphocine-3,7-dicarboxylate Traditional Name: 1,9-ditert-butyl-11-phenyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-3,7-dicarboxylic acid dimethyl ester Formula: C31H35O6P MolecularWeight: 534.579761

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC2=C1OP(OC3=C(C2)C=C(C=C3C(C)(C)C)C(=O)OC)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC(=CC2=C1OP(OC3=C(C2)C=C(C=C3C(C)(C)C)C(=O)OC)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C31H35O6P/c1-30(2,3)24-17-21(28(32)34-7)15-19-14-20-16-22(29(33)35-8)18-25(31(4,5)6)27(20)37-38(36-26(19)24)23-12-10-9-11-13-23/h9-13,15-18H,14H2,1-8H3