(phenylmethyl) 2-azanyl-3-[1-[di(propan-2-yloxy)phosphorylmethyl]-2-oxidanylidene-pyridin-4-yl]propanoate

Systemtic Name: (phenylmethyl) 2-azanyl-3-[1-[di(propan-2-yloxy)phosphorylmethyl]-2-oxidanylidene-pyridin-4-yl]propanoate Openeye Name: benzyl 2-amino-3-[1-(diisopropoxyphosphorylmethyl)-2-oxo-4-pyridyl]propanoate CAS Name: 2-amino-3-[1-[di(propan-2-yloxy)phosphorylmethyl]-2-oxo-4-pyridinyl]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-amino-3-[1-[di(propan-2-yloxy)phosphorylmethyl]-2-oxopyridin-4-yl]propanoate Traditional Name: 2-amino-3-[1-(diisopropoxyphosphorylmethyl)-2-keto-4-pyridyl]propionic acid benzyl ester Formula: C22H31N2O6P MolecularWeight: 450.465101

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(CN1C=CC(=CC1=O)CC(C(=O)OCC2=CC=CC=C2)N)OC(C)C

Isomeric SMILES

CC(C)OP(=O)(CN1C=CC(=CC1=O)CC(C(=O)OCC2=CC=CC=C2)N)OC(C)C

InChI

InChI=1S/C22H31N2O6P/c1-16(2)29-31(27,30-17(3)4)15-24-11-10-19(13-21(24)25)12-20(23)22(26)28-14-18-8-6-5-7-9-18/h5-11,13,16-17,20H,12,14-15,23H2,1-4H3