2-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl]-2-phenyl-indene-1,3-dione

Systemtic Name: 2-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl]-2-phenyl-indene-1,3-dione Openeye Name: 2-[(3-isobutyl-1,2,4-oxadiazol-5-yl)methyl]-2-phenyl-indane-1,3-dione CAS Name: 2-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl]-2-phenylindene-1,3-dione IUPAC Name: 2-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl]-2-phenylindene-1,3-dione Traditional Name: 2-[(3-isobutyl-1,2,4-oxadiazol-5-yl)methyl]-2-phenyl-indane-1,3-quinone Formula: C22H20N2O3 MolecularWeight: 360.4058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NOC(=N1)CC2(C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)CC1=NOC(=N1)CC2(C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4

InChI

InChI=1S/C22H20N2O3/c1-14(2)12-18-23-19(27-24-18)13-22(15-8-4-3-5-9-15)20(25)16-10-6-7-11-17(16)21(22)26/h3-11,14H,12-13H2,1-2H3