methyl 4-(2-acetamidoethanoyloxymethyl)-3-bromanyl-benzoate

Systemtic Name: methyl 4-(2-acetamidoethanoyloxymethyl)-3-bromanyl-benzoate Openeye Name: methyl 4-[(2-acetamidoacetyl)oxymethyl]-3-bromo-benzoate CAS Name: 4-[(2-acetamido-1-oxoethoxy)methyl]-3-bromobenzoic acid methyl ester IUPAC Name: methyl 4-[(2-acetamidoacetyl)oxymethyl]-3-bromobenzoate Traditional Name: 4-[(2-acetamidoacetyl)oxymethyl]-3-bromo-benzoic acid methyl ester Formula: C13H14BrNO5 MolecularWeight: 344.15796

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC(=O)OCC1=C(C=C(C=C1)C(=O)OC)Br

Isomeric SMILES

CC(=O)NCC(=O)OCC1=C(C=C(C=C1)C(=O)OC)Br

InChI

InChI=1S/C13H14BrNO5/c1-8(16)15-6-12(17)20-7-10-4-3-9(5-11(10)14)13(18)19-2/h3-5H,6-7H2,1-2H3,(H,15,16)