3-[4-[1-azanyl-3-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl]phenyl]pentan-3-ylphosphonic acid

Systemtic Name: 3-[4-[1-azanyl-3-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl]phenyl]pentan-3-ylphosphonic acid Openeye Name: [1-[4-[2-amino-1-[(4-fluorophenyl)methyl]-2-oxo-ethyl]phenyl]-1-ethyl-propyl]phosphonic acid CAS Name: 3-[4-[1-amino-3-(4-fluorophenyl)-1-oxopropan-2-yl]phenyl]pentan-3-ylphosphonic acid IUPAC Name: 3-[4-[1-amino-3-(4-fluorophenyl)-1-oxopropan-2-yl]phenyl]pentan-3-ylphosphonic acid Traditional Name: [1-[4-[2-amino-1-(4-fluorobenzyl)-2-keto-ethyl]phenyl]-1-ethyl-propyl]phosphonic acid Formula: C20H25FNO4P MolecularWeight: 393.388964

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC=C(C=C1)C(CC2=CC=C(C=C2)F)C(=O)N)P(=O)(O)O

Isomeric SMILES

CCC(CC)(C1=CC=C(C=C1)C(CC2=CC=C(C=C2)F)C(=O)N)P(=O)(O)O

InChI

InChI=1S/C20H25FNO4P/c1-3-20(4-2,27(24,25)26)16-9-7-15(8-10-16)18(19(22)23)13-14-5-11-17(21)12-6-14/h5-12,18H,3-4,13H2,1-2H3,(H2,22,23)(H2,24,25,26)