6-tert-butyl-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-8-oxidanyl-chromen-2-one

Systemtic Name: 6-tert-butyl-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-8-oxidanyl-chromen-2-one Openeye Name: 6-tert-butyl-8-hydroxy-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]chromen-2-one CAS Name: 6-tert-butyl-8-hydroxy-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-benzopyran-2-one IUPAC Name: 6-tert-butyl-8-hydroxy-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]chromen-2-one Traditional Name: 6-tert-butyl-8-hydroxy-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]coumarin Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=C1)C=C(C(=O)O2)C3=NC(=NO3)C4=CC=C(C=C4)OC)O

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=C1)C=C(C(=O)O2)C3=NC(=NO3)C4=CC=C(C=C4)OC)O

InChI

InChI=1S/C22H20N2O5/c1-22(2,3)14-9-13-10-16(21(26)28-18(13)17(25)11-14)20-23-19(24-29-20)12-5-7-15(27-4)8-6-12/h5-11,25H,1-4H3