4-[2-(1,2,4-triazol-1-yl)phenyl]-4H-cinnolin-3-one

Systemtic Name: 4-[2-(1,2,4-triazol-1-yl)phenyl]-4H-cinnolin-3-one Openeye Name: 4-[2-(1,2,4-triazol-1-yl)phenyl]-4H-cinnolin-3-one CAS Name: 4-[2-(1,2,4-triazol-1-yl)phenyl]-4H-cinnolin-3-one IUPAC Name: 4-[2-(1,2,4-triazol-1-yl)phenyl]-4H-cinnolin-3-one Traditional Name: 4-[2-(1,2,4-triazol-1-yl)phenyl]-4H-cinnolin-3-one Formula: C16H11N5O MolecularWeight: 289.29144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C(=O)N=N2)C3=CC=CC=C3N4C=NC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(C(=O)N=N2)C3=CC=CC=C3N4C=NC=N4

InChI

InChI=1S/C16H11N5O/c22-16-15(11-5-1-3-7-13(11)19-20-16)12-6-2-4-8-14(12)21-10-17-9-18-21/h1-10,15H