(2-bromanyl-4-chloranyl-phenyl) 4-heptoxybenzoate

Systemtic Name: (2-bromanyl-4-chloranyl-phenyl) 4-heptoxybenzoate Openeye Name: (2-bromo-4-chloro-phenyl) 4-heptoxybenzoate CAS Name: 4-heptoxybenzoic acid (2-bromo-4-chlorophenyl) ester IUPAC Name: (2-bromo-4-chlorophenyl) 4-heptoxybenzoate Traditional Name: 4-heptoxybenzoic acid (2-bromo-4-chloro-phenyl) ester Formula: C20H22BrClO3 MolecularWeight: 425.74388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Cl)Br

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Cl)Br

InChI

InChI=1S/C20H22BrClO3/c1-2-3-4-5-6-13-24-17-10-7-15(8-11-17)20(23)25-19-12-9-16(22)14-18(19)21/h7-12,14H,2-6,13H2,1H3