2-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]-7-oxidanyl-chromen-4-one

Systemtic Name: 2-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]-7-oxidanyl-chromen-4-one Openeye Name: 2-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]-7-hydroxy-chromen-4-one CAS Name: 2-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]-7-hydroxy-1-benzopyran-4-one IUPAC Name: 2-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]-7-hydroxychromen-4-one Traditional Name: 2-[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]-7-hydroxy-chromone Formula: C21H18N2O4 MolecularWeight: 362.37862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NOC(=N2)C3=CC(=O)C4=C(O3)C=C(C=C4)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NOC(=N2)C3=CC(=O)C4=C(O3)C=C(C=C4)O

InChI

InChI=1S/C21H18N2O4/c1-21(2,3)13-6-4-12(5-7-13)19-22-20(27-23-19)18-11-16(25)15-9-8-14(24)10-17(15)26-18/h4-11,24H,1-3H3