7-(1,2,4-triazol-1-ylmethyl)chromen-2-one

Systemtic Name: 7-(1,2,4-triazol-1-ylmethyl)chromen-2-one Openeye Name: 7-(1,2,4-triazol-1-ylmethyl)chromen-2-one CAS Name: 7-(1,2,4-triazol-1-ylmethyl)-1-benzopyran-2-one IUPAC Name: 7-(1,2,4-triazol-1-ylmethyl)chromen-2-one Traditional Name: 7-(1,2,4-triazol-1-ylmethyl)coumarin Formula: C12H9N3O2 MolecularWeight: 227.21876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CC(=O)O2)CN3C=NC=N3

Isomeric SMILES

C1=CC(=CC2=C1C=CC(=O)O2)CN3C=NC=N3

InChI

InChI=1S/C12H9N3O2/c16-12-4-3-10-2-1-9(5-11(10)17-12)6-15-8-13-7-14-15/h1-5,7-8H,6H2