(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 3-(phenoxymethyl)-1-benzofuran-2-carboxylate

Systemtic Name: (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 3-(phenoxymethyl)-1-benzofuran-2-carboxylate Openeye Name: (3-isopropyl-1,2,4-oxadiazol-5-yl)methyl 3-(phenoxymethyl)benzofuran-2-carboxylate CAS Name: 3-(phenoxymethyl)-2-benzofurancarboxylic acid (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 3-(phenoxymethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-(phenoxymethyl)coumarilic acid (3-isopropyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NOC(=N1)COC(=O)C2=C(C3=CC=CC=C3O2)COC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=NOC(=N1)COC(=O)C2=C(C3=CC=CC=C3O2)COC4=CC=CC=C4

InChI

InChI=1S/C22H20N2O5/c1-14(2)21-23-19(29-24-21)13-27-22(25)20-17(12-26-15-8-4-3-5-9-15)16-10-6-7-11-18(16)28-20/h3-11,14H,12-13H2,1-2H3