(2-bromanyl-4-propan-2-yl-phenyl) 4-(2-phenoxyethoxy)benzoate

Systemtic Name: (2-bromanyl-4-propan-2-yl-phenyl) 4-(2-phenoxyethoxy)benzoate Openeye Name: (2-bromo-4-isopropyl-phenyl) 4-(2-phenoxyethoxy)benzoate CAS Name: 4-(2-phenoxyethoxy)benzoic acid (2-bromo-4-propan-2-ylphenyl) ester IUPAC Name: (2-bromo-4-propan-2-ylphenyl) 4-(2-phenoxyethoxy)benzoate Traditional Name: 4-(2-phenoxyethoxy)benzoic acid (2-bromo-4-isopropyl-phenyl) ester Formula: C24H23BrO4 MolecularWeight: 455.34102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCOC3=CC=CC=C3)Br

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCOC3=CC=CC=C3)Br

InChI

InChI=1S/C24H23BrO4/c1-17(2)19-10-13-23(22(25)16-19)29-24(26)18-8-11-21(12-9-18)28-15-14-27-20-6-4-3-5-7-20/h3-13,16-17H,14-15H2,1-2H3