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

Systemtic Name: 2-[4-[1-azanyl-3-(3,5-diphenyl-1,2-oxazol-4-yl)-1-oxidanylidene-propan-2-yl]phenyl]propan-2-ylphosphonic acid Openeye Name: [1-[4-[2-amino-1-[(3,5-diphenylisoxazol-4-yl)methyl]-2-oxo-ethyl]phenyl]-1-methyl-ethyl]phosphonic acid CAS Name: 2-[4-[1-amino-3-(3,5-diphenyl-4-isoxazolyl)-1-oxopropan-2-yl]phenyl]propan-2-ylphosphonic acid IUPAC Name: 2-[4-[1-amino-3-(3,5-diphenyl-1,2-oxazol-4-yl)-1-oxopropan-2-yl]phenyl]propan-2-ylphosphonic acid Traditional Name: [1-[4-[2-amino-1-[(3,5-diphenylisoxazol-4-yl)methyl]-2-keto-ethyl]phenyl]-1-methyl-ethyl]phosphonic acid Formula: C27H27N2O5P MolecularWeight: 490.487441

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)C(CC2=C(ON=C2C3=CC=CC=C3)C4=CC=CC=C4)C(=O)N)P(=O)(O)O

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)C(CC2=C(ON=C2C3=CC=CC=C3)C4=CC=CC=C4)C(=O)N)P(=O)(O)O

InChI

InChI=1S/C27H27N2O5P/c1-27(2,35(31,32)33)21-15-13-18(14-16-21)22(26(28)30)17-23-24(19-9-5-3-6-10-19)29-34-25(23)20-11-7-4-8-12-20/h3-16,22H,17H2,1-2H3,(H2,28,30)(H2,31,32,33)