3-[3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]-6-methoxy-chromen-2-one

Systemtic Name: 3-[3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]-6-methoxy-chromen-2-one Openeye Name: 3-[3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]-6-methoxy-chromen-2-one CAS Name: 3-[3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]-6-methoxy-1-benzopyran-2-one IUPAC Name: 3-[3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]-6-methoxychromen-2-one Traditional Name: 3-[3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]-6-methoxy-coumarin Formula: C20H17N3O5 MolecularWeight: 379.36608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC(=O)C(=C2)C3=NC(=NN3)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

COC1=CC2=C(C=C1)OC(=O)C(=C2)C3=NC(=NN3)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C20H17N3O5/c1-25-13-5-7-15-12(8-13)9-14(20(24)28-15)19-21-18(22-23-19)11-4-6-16(26-2)17(10-11)27-3/h4-10H,1-3H3,(H,21,22,23)