5-(4-nitrophenyl)-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 5-(4-nitrophenyl)-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Openeye Name: 5-(4-nitrophenyl)-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one CAS Name: 5-(4-nitrophenyl)-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one IUPAC Name: 5-(4-nitrophenyl)-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Traditional Name: 5-(4-nitrophenyl)-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Formula: C17H11N5O3 MolecularWeight: 333.30094

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=NC(=CC(=O)N3N2)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=NC(=CC(=O)N3N2)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H11N5O3/c23-15-10-14(11-6-8-13(9-7-11)22(24)25)18-17-19-16(20-21(15)17)12-4-2-1-3-5-12/h1-10H,(H,18,19,20)