(4-acetamido-2-azanyl-5-cyano-phenyl)methyl ethanoate

Systemtic Name: (4-acetamido-2-azanyl-5-cyano-phenyl)methyl ethanoate Openeye Name: (4-acetamido-2-amino-5-cyano-phenyl)methyl acetate CAS Name: acetic acid (4-acetamido-2-amino-5-cyanophenyl)methyl ester IUPAC Name: (4-acetamido-2-amino-5-cyanophenyl)methyl acetate Traditional Name: acetic acid (4-acetamido-2-amino-5-cyano-benzyl) ester Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1C#N)COC(=O)C)N

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1C#N)COC(=O)C)N

InChI

InChI=1S/C12H13N3O3/c1-7(16)15-12-4-11(14)10(3-9(12)5-13)6-18-8(2)17/h3-4H,6,14H2,1-2H3,(H,15,16)