ethyl 4,6-bis(bromanyl)-2-[[(3-chlorophenyl)amino]methyl]-5-methoxy-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 4,6-bis(bromanyl)-2-[[(3-chlorophenyl)amino]methyl]-5-methoxy-1-benzofuran-3-carboxylate Openeye Name: ethyl 4,6-dibromo-2-[(3-chloroanilino)methyl]-5-methoxy-benzofuran-3-carboxylate CAS Name: 4,6-dibromo-2-[(3-chloroanilino)methyl]-5-methoxy-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 4,6-dibromo-2-[(3-chloroanilino)methyl]-5-methoxy-1-benzofuran-3-carboxylate Traditional Name: 4,6-dibromo-2-[(3-chloroanilino)methyl]-5-methoxy-benzofuran-3-carboxylic acid ethyl ester Formula: C19H16Br2ClNO4 MolecularWeight: 517.59564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=CC(=C(C(=C21)Br)OC)Br)CNC3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(OC2=CC(=C(C(=C21)Br)OC)Br)CNC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H16Br2ClNO4/c1-3-26-19(24)16-14(9-23-11-6-4-5-10(22)7-11)27-13-8-12(20)18(25-2)17(21)15(13)16/h4-8,23H,3,9H2,1-2H3