4-cyano-N-[[5-(2-methyl-2,3-dihydro-1-benzofuran-6-yl)-1,2-oxazol-3-yl]methyl]benzamide

Systemtic Name: 4-cyano-N-[[5-(2-methyl-2,3-dihydro-1-benzofuran-6-yl)-1,2-oxazol-3-yl]methyl]benzamide Openeye Name: 4-cyano-N-[[5-(2-methyl-2,3-dihydrobenzofuran-6-yl)isoxazol-3-yl]methyl]benzamide CAS Name: 4-cyano-N-[[5-(2-methyl-2,3-dihydrobenzofuran-6-yl)-3-isoxazolyl]methyl]benzamide IUPAC Name: 4-cyano-N-[[5-(2-methyl-2,3-dihydro-1-benzofuran-6-yl)-1,2-oxazol-3-yl]methyl]benzamide Traditional Name: 4-cyano-N-[[5-(2-methylcoumaran-6-yl)isoxazol-3-yl]methyl]benzamide Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(O1)C=C(C=C2)C3=CC(=NO3)CNC(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC1CC2=C(O1)C=C(C=C2)C3=CC(=NO3)CNC(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H17N3O3/c1-13-8-16-6-7-17(9-19(16)26-13)20-10-18(24-27-20)12-23-21(25)15-4-2-14(11-22)3-5-15/h2-7,9-10,13H,8,12H2,1H3,(H,23,25)