[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-(2-bromanyl-4-methyl-phenoxy)ethanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-(2-bromanyl-4-methyl-phenoxy)ethanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-(2-bromo-4-methyl-phenoxy)acetate CAS Name: 2-(2-bromo-4-methylphenoxy)acetic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-(2-bromo-4-methylphenoxy)acetate Traditional Name: 2-(2-bromo-4-methyl-phenoxy)acetic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C14H14BrNO4 MolecularWeight: 340.16926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)OCC(=O)NCC#C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)OCC(=O)NCC#C)Br

InChI

InChI=1S/C14H14BrNO4/c1-3-6-16-13(17)8-20-14(18)9-19-12-5-4-10(2)7-11(12)15/h1,4-5,7H,6,8-9H2,2H3,(H,16,17)