(3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-butanoate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-butanoate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-indan-5-yl-4-oxo-butanoate CAS Name: 4-(2,3-dihydro-1H-inden-5-yl)-4-oxobutanoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 4-(2,3-dihydro-1H-inden-5-yl)-4-oxobutanoate Traditional Name: 4-indan-5-yl-4-keto-butyric acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C22H20N2O4 MolecularWeight: 376.4052

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C(=O)CCC(=O)OCC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)C(=O)CCC(=O)OCC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C22H20N2O4/c25-19(18-10-9-15-7-4-8-17(15)13-18)11-12-21(26)27-14-20-23-22(24-28-20)16-5-2-1-3-6-16/h1-3,5-6,9-10,13H,4,7-8,11-12,14H2