methyl (2S)-2-acetamido-3-(4-phosphonooxyphenyl)propanoate

Systemtic Name: methyl (2S)-2-acetamido-3-(4-phosphonooxyphenyl)propanoate Openeye Name: methyl (2S)-2-acetamido-3-(4-phosphonooxyphenyl)propanoate CAS Name: (2S)-2-acetamido-3-(4-phosphonooxyphenyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-acetamido-3-(4-phosphonooxyphenyl)propanoate Traditional Name: (2S)-2-acetamido-3-(4-phosphonooxyphenyl)propionic acid methyl ester Formula: C12H16NO7P MolecularWeight: 317.231701

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=C(C=C1)OP(=O)(O)O)C(=O)OC

Isomeric SMILES

CC(=O)N[C@@H](CC1=CC=C(C=C1)OP(=O)(O)O)C(=O)OC

InChI

InChI=1S/C12H16NO7P/c1-8(14)13-11(12(15)19-2)7-9-3-5-10(6-4-9)20-21(16,17)18/h3-6,11H,7H2,1-2H3,(H,13,14)(H2,16,17,18)/t11-/m0/s1