(E)-4-(7-chloranyl-2,2,4,5-tetramethyl-3H-1-benzofuran-6-yl)but-3-en-2-one

Systemtic Name: (E)-4-(7-chloranyl-2,2,4,5-tetramethyl-3H-1-benzofuran-6-yl)but-3-en-2-one Openeye Name: (E)-4-(7-chloro-2,2,4,5-tetramethyl-3H-benzofuran-6-yl)but-3-en-2-one CAS Name: (E)-4-(7-chloro-2,2,4,5-tetramethyl-3H-benzofuran-6-yl)-3-buten-2-one IUPAC Name: (E)-4-(7-chloro-2,2,4,5-tetramethyl-3H-1-benzofuran-6-yl)but-3-en-2-one Traditional Name: (E)-4-(7-chloro-2,2,4,5-tetramethyl-coumaran-6-yl)but-3-en-2-one Formula: C16H19ClO2 MolecularWeight: 278.77386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CC(OC2=C(C(=C1C)C=CC(=O)C)Cl)(C)C

Isomeric SMILES

CC1=C2CC(OC2=C(C(=C1C)/C=C/C(=O)C)Cl)(C)C

InChI

InChI=1S/C16H19ClO2/c1-9(18)6-7-12-10(2)11(3)13-8-16(4,5)19-15(13)14(12)17/h6-7H,8H2,1-5H3/b7-6+