3,7-dimethyl-5-propan-2-yl-1-benzofuran-2-carboxylate

Systemtic Name: 3,7-dimethyl-5-propan-2-yl-1-benzofuran-2-carboxylate Openeye Name: 5-isopropyl-3,7-dimethyl-benzofuran-2-carboxylate CAS Name: 3,7-dimethyl-5-propan-2-yl-2-benzofurancarboxylate IUPAC Name: 3,7-dimethyl-5-propan-2-yl-1-benzofuran-2-carboxylate Traditional Name: 5-isopropyl-3,7-dimethyl-coumarilate Formula: C14H15O3- MolecularWeight: 231.2671

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)C(C)C)C(=C(O2)C(=O)[O-])C

Isomeric SMILES

CC1=C2C(=CC(=C1)C(C)C)C(=C(O2)C(=O)[O-])C

InChI

InChI=1S/C14H16O3/c1-7(2)10-5-8(3)12-11(6-10)9(4)13(17-12)14(15)16/h5-7H,1-4H3,(H,15,16)/p-1