[4-[(2S)-2-azanyl-3,3-bis(oxidanyl)propyl]phenyl] ethanoate

Systemtic Name: [4-[(2S)-2-azanyl-3,3-bis(oxidanyl)propyl]phenyl] ethanoate Openeye Name: [4-[(2S)-2-amino-3,3-dihydroxy-propyl]phenyl] acetate CAS Name: acetic acid [4-[(2S)-2-amino-3,3-dihydroxypropyl]phenyl] ester IUPAC Name: [4-[(2S)-2-amino-3,3-dihydroxypropyl]phenyl] acetate Traditional Name: acetic acid [4-[(2S)-2-amino-3,3-dihydroxy-propyl]phenyl] ester Formula: C11H15NO4 MolecularWeight: 225.2411

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)CC(C(O)O)N

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C[C@@H](C(O)O)N

InChI

InChI=1S/C11H15NO4/c1-7(13)16-9-4-2-8(3-5-9)6-10(12)11(14)15/h2-5,10-11,14-15H,6,12H2,1H3/t10-/m0/s1