ethyl 5-bromanyl-3-[(2-chloranyl-4-nitro-phenoxy)methyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 5-bromanyl-3-[(2-chloranyl-4-nitro-phenoxy)methyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 5-bromo-3-[(2-chloro-4-nitro-phenoxy)methyl]benzofuran-2-carboxylate CAS Name: 5-bromo-3-[(2-chloro-4-nitrophenoxy)methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-bromo-3-[(2-chloro-4-nitrophenoxy)methyl]-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-[(2-chloro-4-nitro-phenoxy)methyl]coumarilic acid ethyl ester Formula: C18H13BrClNO6 MolecularWeight: 454.65592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H13BrClNO6/c1-2-25-18(22)17-13(12-7-10(19)3-5-15(12)27-17)9-26-16-6-4-11(21(23)24)8-14(16)20/h3-8H,2,9H2,1H3