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

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 3-bromanyl-4-methoxy-benzoate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 3-bromo-4-methoxy-benzoate CAS Name: 3-bromo-4-methoxybenzoic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 3-bromo-4-methoxybenzoate Traditional Name: 3-bromo-4-methoxy-benzoic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C14H15BrN2O5 MolecularWeight: 371.1833

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC(=O)NC(=O)NCC=C)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC(=O)NC(=O)NCC=C)Br

InChI

InChI=1S/C14H15BrN2O5/c1-3-6-16-14(20)17-12(18)8-22-13(19)9-4-5-11(21-2)10(15)7-9/h3-5,7H,1,6,8H2,2H3,(H2,16,17,18,20)