5,7-dimethoxy-3-(1H-1,2,4-triazol-5-yl)chromen-2-one

Systemtic Name: 5,7-dimethoxy-3-(1H-1,2,4-triazol-5-yl)chromen-2-one Openeye Name: 5,7-dimethoxy-3-(1H-1,2,4-triazol-5-yl)chromen-2-one CAS Name: 5,7-dimethoxy-3-(1H-1,2,4-triazol-5-yl)-1-benzopyran-2-one IUPAC Name: 5,7-dimethoxy-3-(1H-1,2,4-triazol-5-yl)chromen-2-one Traditional Name: 5,7-dimethoxy-3-(1H-1,2,4-triazol-5-yl)coumarin Formula: C13H11N3O4 MolecularWeight: 273.24414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C=C(C(=O)OC2=C1)C3=NC=NN3)OC

Isomeric SMILES

COC1=CC(=C2C=C(C(=O)OC2=C1)C3=NC=NN3)OC

InChI

InChI=1S/C13H11N3O4/c1-18-7-3-10(19-2)8-5-9(12-14-6-15-16-12)13(17)20-11(8)4-7/h3-6H,1-2H3,(H,14,15,16)