5-[3-(5-bromanyl-2-phenylmethoxy-phenyl)thiophen-2-yl]-2-chloranyl-benzoate

Systemtic Name: 5-[3-(5-bromanyl-2-phenylmethoxy-phenyl)thiophen-2-yl]-2-chloranyl-benzoate Openeye Name: 5-[3-(2-benzyloxy-5-bromo-phenyl)-2-thienyl]-2-chloro-benzoate CAS Name: 5-[3-(5-bromo-2-phenylmethoxyphenyl)-2-thiophenyl]-2-chlorobenzoate IUPAC Name: 5-[3-(5-bromo-2-phenylmethoxyphenyl)thiophen-2-yl]-2-chlorobenzoate Traditional Name: 5-[3-(2-benzoxy-5-bromo-phenyl)-2-thienyl]-2-chloro-benzoate Formula: C24H15BrClO3S- MolecularWeight: 498.7961

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)C3=C(SC=C3)C4=CC(=C(C=C4)Cl)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)C3=C(SC=C3)C4=CC(=C(C=C4)Cl)C(=O)[O-]

InChI

InChI=1S/C24H16BrClO3S/c25-17-7-9-22(29-14-15-4-2-1-3-5-15)19(13-17)18-10-11-30-23(18)16-6-8-21(26)20(12-16)24(27)28/h1-13H,14H2,(H,27,28)/p-1