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

Systemtic Name: 6-tert-butyl-3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-8-oxidanyl-chromen-2-one Openeye Name: 6-tert-butyl-3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-8-hydroxy-chromen-2-one CAS Name: 6-tert-butyl-3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-8-hydroxy-1-benzopyran-2-one IUPAC Name: 6-tert-butyl-3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-8-hydroxychromen-2-one Traditional Name: 6-tert-butyl-3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-8-hydroxy-coumarin Formula: C21H17ClN2O4 MolecularWeight: 396.82368

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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)Cl)O

Isomeric SMILES

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

InChI

InChI=1S/C21H17ClN2O4/c1-21(2,3)13-8-12-9-15(20(26)27-17(12)16(25)10-13)19-23-18(24-28-19)11-4-6-14(22)7-5-11/h4-10,25H,1-3H3