[5-(5-bromanylfuran-2-yl)-1,3,4-oxadiazol-2-yl]methyl 3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanoate

Systemtic Name: [5-(5-bromanylfuran-2-yl)-1,3,4-oxadiazol-2-yl]methyl 3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanoate Openeye Name: [5-(5-bromo-2-furyl)-1,3,4-oxadiazol-2-yl]methyl 3-(7-methoxy-4-methyl-2-oxo-chromen-3-yl)propanoate CAS Name: 3-(7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)propanoic acid [5-(5-bromo-2-furanyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(5-bromofuran-2-yl)-1,3,4-oxadiazol-2-yl]methyl 3-(7-methoxy-4-methyl-2-oxochromen-3-yl)propanoate Traditional Name: 3-(2-keto-7-methoxy-4-methyl-chromen-3-yl)propionic acid [5-(5-bromo-2-furyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C21H17BrN2O7 MolecularWeight: 489.27288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)OCC3=NN=C(O3)C4=CC=C(O4)Br

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)OCC3=NN=C(O3)C4=CC=C(O4)Br

InChI

InChI=1S/C21H17BrN2O7/c1-11-13-4-3-12(27-2)9-16(13)30-21(26)14(11)5-8-19(25)28-10-18-23-24-20(31-18)15-6-7-17(22)29-15/h3-4,6-7,9H,5,8,10H2,1-2H3