[5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-1,2-oxazol-3-yl]methyl 3,4,5-triethoxybenzoate

Systemtic Name: [5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-1,2-oxazol-3-yl]methyl 3,4,5-triethoxybenzoate Openeye Name: [5-(2-methyl-2,3-dihydrobenzofuran-5-yl)isoxazol-3-yl]methyl 3,4,5-triethoxybenzoate CAS Name: 3,4,5-triethoxybenzoic acid [5-(2-methyl-2,3-dihydrobenzofuran-5-yl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-1,2-oxazol-3-yl]methyl 3,4,5-triethoxybenzoate Traditional Name: 3,4,5-triethoxybenzoic acid [5-(2-methylcoumaran-5-yl)isoxazol-3-yl]methyl ester Formula: C26H29NO7 MolecularWeight: 467.51096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCC2=NOC(=C2)C3=CC4=C(C=C3)OC(C4)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCC2=NOC(=C2)C3=CC4=C(C=C3)OC(C4)C

InChI

InChI=1S/C26H29NO7/c1-5-29-23-12-19(13-24(30-6-2)25(23)31-7-3)26(28)32-15-20-14-22(34-27-20)17-8-9-21-18(11-17)10-16(4)33-21/h8-9,11-14,16H,5-7,10,15H2,1-4H3