[(1S,2S)-1-dimethoxyphosphoryl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenyl-ethyl] benzoate

Systemtic Name: [(1S,2S)-1-dimethoxyphosphoryl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenyl-ethyl] benzoate Openeye Name: [(1S,2S)-2-(tert-butoxycarbonylamino)-1-dimethoxyphosphoryl-2-phenyl-ethyl] benzoate CAS Name: benzoic acid [(1S,2S)-1-dimethoxyphosphoryl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-phenylethyl] ester IUPAC Name: [(1S,2S)-1-dimethoxyphosphoryl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylethyl] benzoate Traditional Name: benzoic acid [(1S,2S)-2-(tert-butoxycarbonylamino)-1-dimethoxyphosphoryl-2-phenyl-ethyl] ester Formula: C22H28NO7P MolecularWeight: 449.433981

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C1=CC=CC=C1)C(OC(=O)C2=CC=CC=C2)P(=O)(OC)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](C1=CC=CC=C1)[C@@H](OC(=O)C2=CC=CC=C2)P(=O)(OC)OC

InChI

InChI=1S/C22H28NO7P/c1-22(2,3)30-21(25)23-18(16-12-8-6-9-13-16)20(31(26,27-4)28-5)29-19(24)17-14-10-7-11-15-17/h6-15,18,20H,1-5H3,(H,23,25)/t18-,20-/m0/s1