2-[[1-azanyl-3-oxidanylidene-1-(4-phenylphenyl)-3-propanoyloxy-propan-2-yl]amino]propan-2-ylphosphonic acid

Systemtic Name: 2-[[1-azanyl-3-oxidanylidene-1-(4-phenylphenyl)-3-propanoyloxy-propan-2-yl]amino]propan-2-ylphosphonic acid Openeye Name: [1-[[1-[amino-(4-phenylphenyl)methyl]-2-oxo-2-propanoyloxy-ethyl]amino]-1-methyl-ethyl]phosphonic acid CAS Name: 2-[[1-amino-3-oxo-3-(1-oxopropoxy)-1-(4-phenylphenyl)propan-2-yl]amino]propan-2-ylphosphonic acid IUPAC Name: 2-[[1-amino-3-oxo-1-(4-phenylphenyl)-3-propanoyloxypropan-2-yl]amino]propan-2-ylphosphonic acid Traditional Name: [1-[[1-[amino-(4-phenylphenyl)methyl]-2-keto-2-propionyloxy-ethyl]amino]-1-methyl-ethyl]phosphonic acid Formula: C21H27N2O6P MolecularWeight: 434.422641

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N2O6P/c1-4-17(24)29-20(25)19(23-21(2,3)30(26,27)28)18(22)16-12-10-15(11-13-16)14-8-6-5-7-9-14/h5-13,18-19,23H,4,22H2,1-3H3,(H2,26,27,28)