(2-acetyloxy-4-azanyl-5-ethynyl-phenyl) ethanoate

Systemtic Name: (2-acetyloxy-4-azanyl-5-ethynyl-phenyl) ethanoate Openeye Name: (2-acetoxy-4-amino-5-ethynyl-phenyl) acetate CAS Name: acetic acid (2-acetyloxy-4-amino-5-ethynylphenyl) ester IUPAC Name: (2-acetyloxy-4-amino-5-ethynylphenyl) acetate Traditional Name: acetic acid (2-acetoxy-4-amino-5-ethynyl-phenyl) ester Formula: C12H11NO4 MolecularWeight: 233.22004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11NO4/c1-4-9-5-11(16-7(2)14)12(6-10(9)13)17-8(3)15/h1,5-6H,13H2,2-3H3