[6-tert-butyl-3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-oxidanylidene-chromen-8-yl] propanoate

Systemtic Name: [6-tert-butyl-3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-oxidanylidene-chromen-8-yl] propanoate Openeye Name: [6-tert-butyl-3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-chromen-8-yl] propanoate CAS Name: propanoic acid [6-tert-butyl-3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-benzopyran-8-yl] ester IUPAC Name: [6-tert-butyl-3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-oxochromen-8-yl] propanoate Traditional Name: propionic acid [6-tert-butyl-3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-keto-chromen-8-yl] ester Formula: C26H26N2O7 MolecularWeight: 478.49384

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C2C(=CC(=C1)C(C)(C)C)C=C(C(=O)O2)C3=NC(=NO3)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCC(=O)OC1=C2C(=CC(=C1)C(C)(C)C)C=C(C(=O)O2)C3=NC(=NO3)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C26H26N2O7/c1-7-21(29)33-20-13-16(26(2,3)4)10-15-11-17(25(30)34-22(15)20)24-27-23(28-35-24)14-8-9-18(31-5)19(12-14)32-6/h8-13H,7H2,1-6H3