[6-hexyl-2-oxidanylidene-3-(5-phenyl-1,3,4-oxadiazol-2-yl)chromen-7-yl] ethanoate

Systemtic Name: [6-hexyl-2-oxidanylidene-3-(5-phenyl-1,3,4-oxadiazol-2-yl)chromen-7-yl] ethanoate Openeye Name: [6-hexyl-2-oxo-3-(5-phenyl-1,3,4-oxadiazol-2-yl)chromen-7-yl] acetate CAS Name: acetic acid [6-hexyl-2-oxo-3-(5-phenyl-1,3,4-oxadiazol-2-yl)-1-benzopyran-7-yl] ester IUPAC Name: [6-hexyl-2-oxo-3-(5-phenyl-1,3,4-oxadiazol-2-yl)chromen-7-yl] acetate Traditional Name: acetic acid [6-hexyl-2-keto-3-(5-phenyl-1,3,4-oxadiazol-2-yl)chromen-7-yl] ester Formula: C25H24N2O5 MolecularWeight: 432.46846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C=C(C(=O)O2)C3=NN=C(O3)C4=CC=CC=C4)OC(=O)C

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C=C(C(=O)O2)C3=NN=C(O3)C4=CC=CC=C4)OC(=O)C

InChI

InChI=1S/C25H24N2O5/c1-3-4-5-7-12-18-13-19-14-20(25(29)31-22(19)15-21(18)30-16(2)28)24-27-26-23(32-24)17-10-8-6-9-11-17/h6,8-11,13-15H,3-5,7,12H2,1-2H3