(2-azanyl-2-oxidanylidene-ethyl) 3-bromanyl-4-ethoxy-5-methoxy-benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 3-bromanyl-4-ethoxy-5-methoxy-benzoate Openeye Name: (2-amino-2-oxo-ethyl) 3-bromo-4-ethoxy-5-methoxy-benzoate CAS Name: 3-bromo-4-ethoxy-5-methoxybenzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 3-bromo-4-ethoxy-5-methoxybenzoate Traditional Name: 3-bromo-4-ethoxy-5-methoxy-benzoic acid (2-amino-2-keto-ethyl) ester Formula: C12H14BrNO5 MolecularWeight: 332.14726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)OCC(=O)N)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)OCC(=O)N)OC

InChI

InChI=1S/C12H14BrNO5/c1-3-18-11-8(13)4-7(5-9(11)17-2)12(16)19-6-10(14)15/h4-5H,3,6H2,1-2H3,(H2,14,15)