2-[4-[1-azanyl-1-oxidanylidene-3-(5-phenyl-1,2-oxazol-4-yl)propan-2-yl]phenyl]propan-2-ylphosphonic acid

Systemtic Name: 2-[4-[1-azanyl-1-oxidanylidene-3-(5-phenyl-1,2-oxazol-4-yl)propan-2-yl]phenyl]propan-2-ylphosphonic acid Openeye Name: [1-[4-[2-amino-2-oxo-1-[(5-phenylisoxazol-4-yl)methyl]ethyl]phenyl]-1-methyl-ethyl]phosphonic acid CAS Name: 2-[4-[1-amino-1-oxo-3-(5-phenyl-4-isoxazolyl)propan-2-yl]phenyl]propan-2-ylphosphonic acid IUPAC Name: 2-[4-[1-amino-1-oxo-3-(5-phenyl-1,2-oxazol-4-yl)propan-2-yl]phenyl]propan-2-ylphosphonic acid Traditional Name: [1-[4-[2-amino-2-keto-1-[(5-phenylisoxazol-4-yl)methyl]ethyl]phenyl]-1-methyl-ethyl]phosphonic acid Formula: C21H23N2O5P MolecularWeight: 414.391481

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)C(CC2=C(ON=C2)C3=CC=CC=C3)C(=O)N)P(=O)(O)O

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)C(CC2=C(ON=C2)C3=CC=CC=C3)C(=O)N)P(=O)(O)O

InChI

InChI=1S/C21H23N2O5P/c1-21(2,29(25,26)27)17-10-8-14(9-11-17)18(20(22)24)12-16-13-23-28-19(16)15-6-4-3-5-7-15/h3-11,13,18H,12H2,1-2H3,(H2,22,24)(H2,25,26,27)