(3-chloranyl-4-methyl-phenyl) 5-bromanyl-2-propoxy-benzoate

Systemtic Name: (3-chloranyl-4-methyl-phenyl) 5-bromanyl-2-propoxy-benzoate Openeye Name: (3-chloro-4-methyl-phenyl) 5-bromo-2-propoxy-benzoate CAS Name: 5-bromo-2-propoxybenzoic acid (3-chloro-4-methylphenyl) ester IUPAC Name: (3-chloro-4-methylphenyl) 5-bromo-2-propoxybenzoate Traditional Name: 5-bromo-2-propoxy-benzoic acid (3-chloro-4-methyl-phenyl) ester Formula: C17H16BrClO3 MolecularWeight: 383.66414

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)C(=O)OC2=CC(=C(C=C2)C)Cl

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)C(=O)OC2=CC(=C(C=C2)C)Cl

InChI

InChI=1S/C17H16BrClO3/c1-3-8-21-16-7-5-12(18)9-14(16)17(20)22-13-6-4-11(2)15(19)10-13/h4-7,9-10H,3,8H2,1-2H3