2-phenyl-5-propan-2-yl-1H-1,2,4-triazol-3-one

Systemtic Name: 2-phenyl-5-propan-2-yl-1H-1,2,4-triazol-3-one Openeye Name: 5-isopropyl-2-phenyl-1H-1,2,4-triazol-3-one CAS Name: 2-phenyl-5-propan-2-yl-1H-1,2,4-triazol-3-one IUPAC Name: 2-phenyl-5-propan-2-yl-1H-1,2,4-triazol-3-one Traditional Name: 5-isopropyl-2-phenyl-1H-1,2,4-triazol-3-one Formula: C11H13N3O MolecularWeight: 203.24042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=O)N(N1)C2=CC=CC=C2

Isomeric SMILES

CC(C)C1=NC(=O)N(N1)C2=CC=CC=C2

InChI

InChI=1S/C11H13N3O/c1-8(2)10-12-11(15)14(13-10)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,12,13,15)