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

Systemtic Name: 2-[4-[4-(5-phenyl-1,2-oxazol-4-yl)butanoylamino]phenyl]propan-2-ylphosphonic acid Openeye Name: [1-methyl-1-[4-[4-(5-phenylisoxazol-4-yl)butanoylamino]phenyl]ethyl]phosphonic acid CAS Name: 2-[4-[[1-oxo-4-(5-phenyl-4-isoxazolyl)butyl]amino]phenyl]propan-2-ylphosphonic acid IUPAC Name: 2-[4-[4-(5-phenyl-1,2-oxazol-4-yl)butanoylamino]phenyl]propan-2-ylphosphonic acid Traditional Name: [1-methyl-1-[4-[4-(5-phenylisoxazol-4-yl)butanoylamino]phenyl]ethyl]phosphonic acid Formula: C22H25N2O5P MolecularWeight: 428.418061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)NC(=O)CCCC2=C(ON=C2)C3=CC=CC=C3)P(=O)(O)O

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)NC(=O)CCCC2=C(ON=C2)C3=CC=CC=C3)P(=O)(O)O

InChI

InChI=1S/C22H25N2O5P/c1-22(2,30(26,27)28)18-11-13-19(14-12-18)24-20(25)10-6-9-17-15-23-29-21(17)16-7-4-3-5-8-16/h3-5,7-8,11-15H,6,9-10H2,1-2H3,(H,24,25)(H2,26,27,28)