3-[4-[2-(5-phenyl-1,2-oxazol-4-yl)ethanoylamino]phenyl]pentan-3-ylphosphonic acid

Systemtic Name: 3-[4-[2-(5-phenyl-1,2-oxazol-4-yl)ethanoylamino]phenyl]pentan-3-ylphosphonic acid Openeye Name: [1-ethyl-1-[4-[[2-(5-phenylisoxazol-4-yl)acetyl]amino]phenyl]propyl]phosphonic acid CAS Name: 3-[4-[[1-oxo-2-(5-phenyl-4-isoxazolyl)ethyl]amino]phenyl]pentan-3-ylphosphonic acid IUPAC Name: 3-[4-[[2-(5-phenyl-1,2-oxazol-4-yl)acetyl]amino]phenyl]pentan-3-ylphosphonic acid Traditional Name: [1-ethyl-1-[4-[[2-(5-phenylisoxazol-4-yl)acetyl]amino]phenyl]propyl]phosphonic acid Formula: C22H25N2O5P MolecularWeight: 428.418061

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N2O5P/c1-3-22(4-2,30(26,27)28)18-10-12-19(13-11-18)24-20(25)14-17-15-23-29-21(17)16-8-6-5-7-9-16/h5-13,15H,3-4,14H2,1-2H3,(H,24,25)(H2,26,27,28)