[(3,5-ditert-butyl-4-oxidanyl-phenyl)-(pyridin-3-ylamino)methyl]phosphonic acid

Systemtic Name: [(3,5-ditert-butyl-4-oxidanyl-phenyl)-(pyridin-3-ylamino)methyl]phosphonic acid Openeye Name: [(3,5-ditert-butyl-4-hydroxy-phenyl)-(3-pyridylamino)methyl]phosphonic acid CAS Name: [(3,5-ditert-butyl-4-hydroxyphenyl)-(3-pyridinylamino)methyl]phosphonic acid IUPAC Name: [(3,5-ditert-butyl-4-hydroxyphenyl)-(pyridin-3-ylamino)methyl]phosphonic acid Traditional Name: [(3,5-ditert-butyl-4-hydroxy-phenyl)-(3-pyridylamino)methyl]phosphonic acid Formula: C20H29N2O4P MolecularWeight: 392.429021

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(NC2=CN=CC=C2)P(=O)(O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(NC2=CN=CC=C2)P(=O)(O)O

InChI

InChI=1S/C20H29N2O4P/c1-19(2,3)15-10-13(11-16(17(15)23)20(4,5)6)18(27(24,25)26)22-14-8-7-9-21-12-14/h7-12,18,22-23H,1-6H3,(H2,24,25,26)