(2Z)-5-bromanyl-2-[[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene]-1-benzofuran-3-one

Systemtic Name: (2Z)-5-bromanyl-2-[[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene]-1-benzofuran-3-one Openeye Name: (2Z)-5-bromo-2-[(4-isopentyloxy-3-methoxy-phenyl)methylene]benzofuran-3-one CAS Name: (2Z)-5-bromo-2-[[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene]-3-benzofuranone IUPAC Name: (2Z)-5-bromo-2-[[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene]-1-benzofuran-3-one Traditional Name: (2Z)-5-bromo-2-(4-isoamoxy-3-methoxy-benzylidene)coumaran-3-one Formula: C21H21BrO4 MolecularWeight: 417.29304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C=C2C(=O)C3=C(O2)C=CC(=C3)Br)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)/C=C\2/C(=O)C3=C(O2)C=CC(=C3)Br)OC

InChI

InChI=1S/C21H21BrO4/c1-13(2)8-9-25-18-6-4-14(10-19(18)24-3)11-20-21(23)16-12-15(22)5-7-17(16)26-20/h4-7,10-13H,8-9H2,1-3H3/b20-11-