(2Z)-6-[(4-bromophenyl)methoxy]-2-(pyridin-3-ylmethylidene)-1-benzofuran-3-one

Systemtic Name: (2Z)-6-[(4-bromophenyl)methoxy]-2-(pyridin-3-ylmethylidene)-1-benzofuran-3-one Openeye Name: (2Z)-6-[(4-bromophenyl)methoxy]-2-(3-pyridylmethylene)benzofuran-3-one CAS Name: (2Z)-6-[(4-bromophenyl)methoxy]-2-(3-pyridinylmethylidene)-3-benzofuranone IUPAC Name: (2Z)-6-[(4-bromophenyl)methoxy]-2-(pyridin-3-ylmethylidene)-1-benzofuran-3-one Traditional Name: (2Z)-6-(4-bromobenzyl)oxy-2-(3-pyridylmethylene)coumaran-3-one Formula: C21H14BrNO3 MolecularWeight: 408.24476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC(=CN=C1)/C=C\2/C(=O)C3=C(O2)C=C(C=C3)OCC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H14BrNO3/c22-16-5-3-14(4-6-16)13-25-17-7-8-18-19(11-17)26-20(21(18)24)10-15-2-1-9-23-12-15/h1-12H,13H2/b20-10-