[2-(cyclopropylamino)-2-oxidanylidene-ethyl] 3-bromanyl-4-methoxy-benzoate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl] 3-bromanyl-4-methoxy-benzoate Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl] 3-bromo-4-methoxy-benzoate CAS Name: 3-bromo-4-methoxybenzoic acid [2-(cyclopropylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl] 3-bromo-4-methoxybenzoate Traditional Name: 3-bromo-4-methoxy-benzoic acid [2-(cyclopropylamino)-2-keto-ethyl] ester Formula: C13H14BrNO4 MolecularWeight: 328.15856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC(=O)NC2CC2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC(=O)NC2CC2)Br

InChI

InChI=1S/C13H14BrNO4/c1-18-11-5-2-8(6-10(11)14)13(17)19-7-12(16)15-9-3-4-9/h2,5-6,9H,3-4,7H2,1H3,(H,15,16)