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

Systemtic Name: [2-acetyloxy-4-[(2S)-2,3-bis(azanyl)-3-oxidanylidene-propyl]phenyl] ethanoate Openeye Name: [2-acetoxy-4-[(2S)-2,3-diamino-3-oxo-propyl]phenyl] acetate CAS Name: acetic acid [2-acetyloxy-4-[(2S)-2,3-diamino-3-oxopropyl]phenyl] ester IUPAC Name: [2-acetyloxy-4-[(2S)-2,3-diamino-3-oxopropyl]phenyl] acetate Traditional Name: acetic acid [2-acetoxy-4-[(2S)-2,3-diamino-3-keto-propyl]phenyl] ester Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O5/c1-7(16)19-11-4-3-9(5-10(14)13(15)18)6-12(11)20-8(2)17/h3-4,6,10H,5,14H2,1-2H3,(H2,15,18)/t10-/m0/s1