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

Systemtic Name: (2Z)-5-chloranyl-2-[[4-(3-methylbutoxy)phenyl]methylidene]-1-benzofuran-3-one Openeye Name: (2Z)-5-chloro-2-[(4-isopentyloxyphenyl)methylene]benzofuran-3-one CAS Name: (2Z)-5-chloro-2-[[4-(3-methylbutoxy)phenyl]methylidene]-3-benzofuranone IUPAC Name: (2Z)-5-chloro-2-[[4-(3-methylbutoxy)phenyl]methylidene]-1-benzofuran-3-one Traditional Name: (2Z)-5-chloro-2-(4-isoamoxybenzylidene)coumaran-3-one Formula: C20H19ClO3 MolecularWeight: 342.81606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=CC(=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClO3/c1-13(2)9-10-23-16-6-3-14(4-7-16)11-19-20(22)17-12-15(21)5-8-18(17)24-19/h3-8,11-13H,9-10H2,1-2H3/b19-11-