[3-bromanyl-2,6-dimethyl-4-(propanoylamino)phenyl] ethanoate

Systemtic Name: [3-bromanyl-2,6-dimethyl-4-(propanoylamino)phenyl] ethanoate Openeye Name: [3-bromo-2,6-dimethyl-4-(propanoylamino)phenyl] acetate CAS Name: acetic acid [3-bromo-2,6-dimethyl-4-(1-oxopropylamino)phenyl] ester IUPAC Name: [3-bromo-2,6-dimethyl-4-(propanoylamino)phenyl] acetate Traditional Name: acetic acid (3-bromo-2,6-dimethyl-4-propionamido-phenyl) ester Formula: C13H16BrNO3 MolecularWeight: 314.17504

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C(=C(C(=C1)C)OC(=O)C)C)Br

Isomeric SMILES

CCC(=O)NC1=C(C(=C(C(=C1)C)OC(=O)C)C)Br

InChI

InChI=1S/C13H16BrNO3/c1-5-11(17)15-10-6-7(2)13(18-9(4)16)8(3)12(10)14/h6H,5H2,1-4H3,(H,15,17)