[(2Z)-3-oxidanylidene-2-[(4-propan-2-ylphenyl)methylidene]-1-benzofuran-6-yl] methanesulfonate

Systemtic Name: [(2Z)-3-oxidanylidene-2-[(4-propan-2-ylphenyl)methylidene]-1-benzofuran-6-yl] methanesulfonate Openeye Name: [(2Z)-2-[(4-isopropylphenyl)methylene]-3-oxo-benzofuran-6-yl] methanesulfonate CAS Name: methanesulfonic acid [(2Z)-3-oxo-2-[(4-propan-2-ylphenyl)methylidene]-6-benzofuranyl] ester IUPAC Name: [(2Z)-3-oxo-2-[(4-propan-2-ylphenyl)methylidene]-1-benzofuran-6-yl] methanesulfonate Traditional Name: methanesulfonic acid [(2Z)-2-(4-isopropylbenzylidene)-3-keto-coumaran-6-yl] ester Formula: C19H18O5S MolecularWeight: 358.40822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OS(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C19H18O5S/c1-12(2)14-6-4-13(5-7-14)10-18-19(20)16-9-8-15(11-17(16)23-18)24-25(3,21)22/h4-12H,1-3H3/b18-10-