3-chloranyl-5,6-dimethoxy-3-phenyl-2-benzofuran-1-one

Systemtic Name: 3-chloranyl-5,6-dimethoxy-3-phenyl-2-benzofuran-1-one Openeye Name: 3-chloro-5,6-dimethoxy-3-phenyl-isobenzofuran-1-one CAS Name: 3-chloro-5,6-dimethoxy-3-phenyl-1-isobenzofuranone IUPAC Name: 3-chloro-5,6-dimethoxy-3-phenyl-2-benzofuran-1-one Traditional Name: 3-chloro-5,6-dimethoxy-3-phenyl-phthalide Formula: C16H13ClO4 MolecularWeight: 304.72502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)OC2(C3=CC=CC=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)OC2(C3=CC=CC=C3)Cl)OC

InChI

InChI=1S/C16H13ClO4/c1-19-13-8-11-12(9-14(13)20-2)16(17,21-15(11)18)10-6-4-3-5-7-10/h3-9H,1-2H3