[[5-tert-butyl-3-methyl-2-[3-(2-methylprop-2-enoyloxy)propoxy]phenyl]methyl-methyl-amino]methylphosphonic acid

Systemtic Name: [[5-tert-butyl-3-methyl-2-[3-(2-methylprop-2-enoyloxy)propoxy]phenyl]methyl-methyl-amino]methylphosphonic acid Openeye Name: [[5-tert-butyl-3-methyl-2-[3-(2-methylprop-2-enoyloxy)propoxy]phenyl]methyl-methyl-amino]methylphosphonic acid CAS Name: [[5-tert-butyl-3-methyl-2-[3-(2-methyl-1-oxoprop-2-enoxy)propoxy]phenyl]methyl-methylamino]methylphosphonic acid IUPAC Name: [[5-tert-butyl-3-methyl-2-[3-(2-methylprop-2-enoyloxy)propoxy]phenyl]methyl-methylamino]methylphosphonic acid Traditional Name: [[5-tert-butyl-2-(3-methacryloyloxypropoxy)-3-methyl-benzyl]-methyl-amino]methylphosphonic acid Formula: C21H34NO6P MolecularWeight: 427.471521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(C)(C)C)CN(C)CP(=O)(O)O)OCCCOC(=O)C(=C)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(C)(C)C)CN(C)CP(=O)(O)O)OCCCOC(=O)C(=C)C

InChI

InChI=1S/C21H34NO6P/c1-15(2)20(23)28-10-8-9-27-19-16(3)11-18(21(4,5)6)12-17(19)13-22(7)14-29(24,25)26/h11-12H,1,8-10,13-14H2,2-7H3,(H2,24,25,26)