5-chloranyl-2-phenyl-1H-1,2,4-triazol-3-one

Systemtic Name: 5-chloranyl-2-phenyl-1H-1,2,4-triazol-3-one Openeye Name: 5-chloro-2-phenyl-1H-1,2,4-triazol-3-one CAS Name: 5-chloro-2-phenyl-1H-1,2,4-triazol-3-one IUPAC Name: 5-chloro-2-phenyl-1H-1,2,4-triazol-3-one Traditional Name: 5-chloro-2-phenyl-1H-1,2,4-triazol-3-one Formula: C8H6ClN3O MolecularWeight: 195.60574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)N=C(N2)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)N=C(N2)Cl

InChI

InChI=1S/C8H6ClN3O/c9-7-10-8(13)12(11-7)6-4-2-1-3-5-6/h1-5H,(H,10,11,13)