1,3,7,9-tetratert-butyl-N,N-dioctyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-amine

Systemtic Name: 1,3,7,9-tetratert-butyl-N,N-dioctyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-amine Openeye Name: 1,3,7,9-tetratert-butyl-N,N-dioctyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-amine CAS Name: 1,3,7,9-tetratert-butyl-N,N-dioctyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-amine IUPAC Name: 1,3,7,9-tetratert-butyl-N,N-dioctyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-amine Traditional Name: dioctyl-(1,3,7,9-tetratert-butyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)amine Formula: C45H76NO2P MolecularWeight: 694.064201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CCCCCCCC)P1OC2=C(C=C(C=C2CC3=CC(=CC(=C3O1)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCCCCCCN(CCCCCCCC)P1OC2=C(C=C(C=C2CC3=CC(=CC(=C3O1)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C45H76NO2P/c1-15-17-19-21-23-25-27-46(28-26-24-22-20-18-16-2)49-47-40-34(30-36(42(3,4)5)32-38(40)44(9,10)11)29-35-31-37(43(6,7)8)33-39(41(35)48-49)45(12,13)14/h30-33H,15-29H2,1-14H3