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

Systemtic Name: 3-(3-phenyl-1H-1,2,4-triazol-5-yl)chromen-2-one Openeye Name: 3-(3-phenyl-1H-1,2,4-triazol-5-yl)chromen-2-one CAS Name: 3-(3-phenyl-1H-1,2,4-triazol-5-yl)-1-benzopyran-2-one IUPAC Name: 3-(3-phenyl-1H-1,2,4-triazol-5-yl)chromen-2-one Traditional Name: 3-(3-phenyl-1H-1,2,4-triazol-5-yl)coumarin Formula: C17H11N3O2 MolecularWeight: 289.28814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=N2)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=N2)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C17H11N3O2/c21-17-13(10-12-8-4-5-9-14(12)22-17)16-18-15(19-20-16)11-6-2-1-3-7-11/h1-10H,(H,18,19,20)