(4-bromanyl-2-propan-2-yl-phenyl) 3-phenethyloxybenzoate

Systemtic Name: (4-bromanyl-2-propan-2-yl-phenyl) 3-phenethyloxybenzoate Openeye Name: (4-bromo-2-isopropyl-phenyl) 3-phenethyloxybenzoate CAS Name: 3-phenethyloxybenzoic acid (4-bromo-2-propan-2-ylphenyl) ester IUPAC Name: (4-bromo-2-propan-2-ylphenyl) 3-phenethyloxybenzoate Traditional Name: 3-phenethyloxybenzoic acid (4-bromo-2-isopropyl-phenyl) ester Formula: C24H23BrO3 MolecularWeight: 439.34162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)Br)OC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)Br)OC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

InChI

InChI=1S/C24H23BrO3/c1-17(2)22-16-20(25)11-12-23(22)28-24(26)19-9-6-10-21(15-19)27-14-13-18-7-4-3-5-8-18/h3-12,15-17H,13-14H2,1-2H3