[(2-oxidanyl-5-propan-2-yl-phenyl)methyl-(phosphonomethyl)amino]methylphosphonic acid

Systemtic Name: [(2-oxidanyl-5-propan-2-yl-phenyl)methyl-(phosphonomethyl)amino]methylphosphonic acid Openeye Name: [(2-hydroxy-5-isopropyl-phenyl)methyl-(phosphonomethyl)amino]methylphosphonic acid CAS Name: [(2-hydroxy-5-propan-2-ylphenyl)methyl-(phosphonomethyl)amino]methylphosphonic acid IUPAC Name: [(2-hydroxy-5-propan-2-ylphenyl)methyl-(phosphonomethyl)amino]methylphosphonic acid Traditional Name: [(2-hydroxy-5-isopropyl-benzyl)-(phosphonomethyl)amino]methylphosphonic acid Formula: C12H21NO7P2 MolecularWeight: 353.245162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H21NO7P2/c1-9(2)10-3-4-12(14)11(5-10)6-13(7-21(15,16)17)8-22(18,19)20/h3-5,9,14H,6-8H2,1-2H3,(H2,15,16,17)(H2,18,19,20)