2,6-ditert-butyl-4-[(1E)-4,4-diphosphonatobuta-1,3-dienyl]phenol

Systemtic Name: 2,6-ditert-butyl-4-[(1E)-4,4-diphosphonatobuta-1,3-dienyl]phenol Openeye Name: 2,6-ditert-butyl-4-[(1E)-4,4-diphosphonatobuta-1,3-dienyl]phenol CAS Name: 2,6-ditert-butyl-4-[(1E)-4,4-diphosphonatobuta-1,3-dienyl]phenol IUPAC Name: 2,6-ditert-butyl-4-[(1E)-4,4-diphosphonatobuta-1,3-dienyl]phenol Traditional Name: 2,6-ditert-butyl-4-[(1E)-4,4-diphosphonatobuta-1,3-dienyl]phenol Formula: C18H24O7P2-4 MolecularWeight: 414.326482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=CC=C(P(=O)([O-])[O-])P(=O)([O-])[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C/C=C(P(=O)([O-])[O-])P(=O)([O-])[O-]

InChI

InChI=1S/C18H28O7P2/c1-17(2,3)13-10-12(11-14(16(13)19)18(4,5)6)8-7-9-15(26(20,21)22)27(23,24)25/h7-11,19H,1-6H3,(H2,20,21,22)(H2,23,24,25)/p-4/b8-7+