5-(4-nitrophenyl)-4-phenyl-2-(phenylmethyl)-1,2,4-triazol-3-one

Systemtic Name: 5-(4-nitrophenyl)-4-phenyl-2-(phenylmethyl)-1,2,4-triazol-3-one Openeye Name: 2-benzyl-5-(4-nitrophenyl)-4-phenyl-1,2,4-triazol-3-one CAS Name: 5-(4-nitrophenyl)-4-phenyl-2-(phenylmethyl)-1,2,4-triazol-3-one IUPAC Name: 2-benzyl-5-(4-nitrophenyl)-4-phenyl-1,2,4-triazol-3-one Traditional Name: 2-benzyl-5-(4-nitrophenyl)-4-phenyl-1,2,4-triazol-3-one Formula: C21H16N4O3 MolecularWeight: 372.37674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)N(C(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)N(C(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C21H16N4O3/c26-21-23(15-16-7-3-1-4-8-16)22-20(24(21)18-9-5-2-6-10-18)17-11-13-19(14-12-17)25(27)28/h1-14H,15H2