(3-phenyl-1,2-oxazol-5-yl)methyl 3-methyl-5-(3-oxidanylidenebutyl)-1-benzofuran-2-carboxylate

Systemtic Name: (3-phenyl-1,2-oxazol-5-yl)methyl 3-methyl-5-(3-oxidanylidenebutyl)-1-benzofuran-2-carboxylate Openeye Name: (3-phenylisoxazol-5-yl)methyl 3-methyl-5-(3-oxobutyl)benzofuran-2-carboxylate CAS Name: 3-methyl-5-(3-oxobutyl)-2-benzofurancarboxylic acid (3-phenyl-5-isoxazolyl)methyl ester IUPAC Name: (3-phenyl-1,2-oxazol-5-yl)methyl 3-methyl-5-(3-oxobutyl)-1-benzofuran-2-carboxylate Traditional Name: 5-(3-ketobutyl)-3-methyl-coumarilic acid (3-phenylisoxazol-5-yl)methyl ester Formula: C24H21NO5 MolecularWeight: 403.42724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)CCC(=O)C)C(=O)OCC3=CC(=NO3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)CCC(=O)C)C(=O)OCC3=CC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C24H21NO5/c1-15(26)8-9-17-10-11-22-20(12-17)16(2)23(29-22)24(27)28-14-19-13-21(25-30-19)18-6-4-3-5-7-18/h3-7,10-13H,8-9,14H2,1-2H3