3-(4-nitrophenyl)-1-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 3-(4-nitrophenyl)-1-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 3-(4-nitrophenyl)-1-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 3-(4-nitrophenyl)-1-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 3-(4-nitrophenyl)-1-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 3-(4-nitrophenyl)-1-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C21H13N5O3 MolecularWeight: 383.35962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C3=NC(=O)C4=CC=CC=C4N23)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C3=NC(=O)C4=CC=CC=C4N23)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C21H13N5O3/c27-20-17-8-4-5-9-18(17)24-19(14-6-2-1-3-7-14)23-25(21(24)22-20)15-10-12-16(13-11-15)26(28)29/h1-13H