2-[[oxidanyl-[1-(phenylmethoxycarbonylamino)propyl]phosphoryl]methyl]-3-phenyl-propanoic acid

Systemtic Name: 2-[[oxidanyl-[1-(phenylmethoxycarbonylamino)propyl]phosphoryl]methyl]-3-phenyl-propanoic acid Openeye Name: 2-benzyl-3-[1-(benzyloxycarbonylamino)propyl-hydroxy-phosphoryl]propanoic acid CAS Name: 2-[[hydroxy-[1-(phenylmethoxycarbonylamino)propyl]phosphoryl]methyl]-3-phenylpropanoic acid IUPAC Name: 2-benzyl-3-[hydroxy-[1-(phenylmethoxycarbonylamino)propyl]phosphoryl]propanoic acid Traditional Name: 2-benzyl-3-[1-(benzyloxycarbonylamino)propyl-hydroxy-phosphoryl]propionic acid Formula: C21H26NO6P MolecularWeight: 419.408001

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Descriptors Computed from Structure

Canonical SMILES:

CCC(NC(=O)OCC1=CC=CC=C1)P(=O)(CC(CC2=CC=CC=C2)C(=O)O)O

Isomeric SMILES

CCC(NC(=O)OCC1=CC=CC=C1)P(=O)(CC(CC2=CC=CC=C2)C(=O)O)O

InChI

InChI=1S/C21H26NO6P/c1-2-19(22-21(25)28-14-17-11-7-4-8-12-17)29(26,27)15-18(20(23)24)13-16-9-5-3-6-10-16/h3-12,18-19H,2,13-15H2,1H3,(H,22,25)(H,23,24)(H,26,27)