2,2,8-trimethyl-7-[[5-(3-methyl-4-nitro-phenyl)-1,3,4-oxadiazol-2-yl]methoxy]-3H-chromen-4-one

Systemtic Name: 2,2,8-trimethyl-7-[[5-(3-methyl-4-nitro-phenyl)-1,3,4-oxadiazol-2-yl]methoxy]-3H-chromen-4-one Openeye Name: 2,2,8-trimethyl-7-[[5-(3-methyl-4-nitro-phenyl)-1,3,4-oxadiazol-2-yl]methoxy]chroman-4-one CAS Name: 2,2,8-trimethyl-7-[[5-(3-methyl-4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methoxy]-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 2,2,8-trimethyl-7-[[5-(3-methyl-4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methoxy]-3H-chromen-4-one Traditional Name: 2,2,8-trimethyl-7-[[5-(3-methyl-4-nitro-phenyl)-1,3,4-oxadiazol-2-yl]methoxy]chroman-4-one Formula: C22H21N3O6 MolecularWeight: 423.41864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NN=C(O2)COC3=C(C4=C(C=C3)C(=O)CC(O4)(C)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NN=C(O2)COC3=C(C4=C(C=C3)C(=O)CC(O4)(C)C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O6/c1-12-9-14(5-7-16(12)25(27)28)21-24-23-19(30-21)11-29-18-8-6-15-17(26)10-22(3,4)31-20(15)13(18)2/h5-9H,10-11H2,1-4H3