2-methylpropyl 4-[2-(3-bromanylphenoxy)propanoylamino]benzoate

Systemtic Name: 2-methylpropyl 4-[2-(3-bromanylphenoxy)propanoylamino]benzoate Openeye Name: isobutyl 4-[2-(3-bromophenoxy)propanoylamino]benzoate CAS Name: 4-[[2-(3-bromophenoxy)-1-oxopropyl]amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[2-(3-bromophenoxy)propanoylamino]benzoate Traditional Name: 4-[2-(3-bromophenoxy)propanoylamino]benzoic acid isobutyl ester Formula: C20H22BrNO4 MolecularWeight: 420.29698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=C(C=C1)NC(=O)C(C)OC2=CC(=CC=C2)Br

Isomeric SMILES

CC(C)COC(=O)C1=CC=C(C=C1)NC(=O)C(C)OC2=CC(=CC=C2)Br

InChI

InChI=1S/C20H22BrNO4/c1-13(2)12-25-20(24)15-7-9-17(10-8-15)22-19(23)14(3)26-18-6-4-5-16(21)11-18/h4-11,13-14H,12H2,1-3H3,(H,22,23)