6-[(4-chlorophenyl)-imidazol-1-yl-methyl]-1-phenyl-benzotriazole nitrate

Systemtic Name: 6-[(4-chlorophenyl)-imidazol-1-yl-methyl]-1-phenyl-benzotriazole nitrate Openeye Name: 6-[(4-chlorophenyl)-imidazol-1-yl-methyl]-1-phenyl-benzotriazole nitrate CAS Name: 6-[(4-chlorophenyl)-(1-imidazolyl)methyl]-1-phenylbenzotriazole nitrate IUPAC Name: 6-[(4-chlorophenyl)-imidazol-1-ylmethyl]-1-phenylbenzotriazole nitrate Traditional Name: 6-[(4-chlorophenyl)-imidazol-1-yl-methyl]-1-phenyl-benzotriazole nitrate Formula: C22H16ClN6O3- MolecularWeight: 447.85384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=CC(=C3)C(C4=CC=C(C=C4)Cl)N5C=CN=C5)N=N2.[N+](=O)([O-])[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=CC(=C3)C(C4=CC=C(C=C4)Cl)N5C=CN=C5)N=N2.[N+](=O)([O-])[O-]

InChI

InChI=1S/C22H16ClN5.NO3/c23-18-9-6-16(7-10-18)22(27-13-12-24-15-27)17-8-11-20-21(14-17)28(26-25-20)19-4-2-1-3-5-19;2-1(3)4/h1-15,22H;/q;-1