methyl 3-(7-tert-butyl-2-oxidanylidene-3-phenyl-3H-1-benzofuran-5-yl)propanoate

Systemtic Name: methyl 3-(7-tert-butyl-2-oxidanylidene-3-phenyl-3H-1-benzofuran-5-yl)propanoate Openeye Name: methyl 3-(7-tert-butyl-2-oxo-3-phenyl-3H-benzofuran-5-yl)propanoate CAS Name: 3-(7-tert-butyl-2-oxo-3-phenyl-3H-benzofuran-5-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(7-tert-butyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propanoate Traditional Name: 3-(7-tert-butyl-2-keto-3-phenyl-coumaran-5-yl)propionic acid methyl ester Formula: C22H24O4 MolecularWeight: 352.42356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2C(=CC(=C1)CCC(=O)OC)C(C(=O)O2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=C2C(=CC(=C1)CCC(=O)OC)C(C(=O)O2)C3=CC=CC=C3

InChI

InChI=1S/C22H24O4/c1-22(2,3)17-13-14(10-11-18(23)25-4)12-16-19(21(24)26-20(16)17)15-8-6-5-7-9-15/h5-9,12-13,19H,10-11H2,1-4H3