(2-phenethyloxyphenyl) 3-bromanyl-4-propoxy-benzoate

Systemtic Name: (2-phenethyloxyphenyl) 3-bromanyl-4-propoxy-benzoate Openeye Name: (2-phenethyloxyphenyl) 3-bromo-4-propoxy-benzoate CAS Name: 3-bromo-4-propoxybenzoic acid (2-phenethyloxyphenyl) ester IUPAC Name: (2-phenethyloxyphenyl) 3-bromo-4-propoxybenzoate Traditional Name: 3-bromo-4-propoxy-benzoic acid (2-phenethyloxyphenyl) ester Formula: C24H23BrO4 MolecularWeight: 455.34102

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2OCCC3=CC=CC=C3)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2OCCC3=CC=CC=C3)Br

InChI

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