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

Systemtic Name: 6-[(4-chlorophenyl)-imidazol-1-yl-methyl]-1-[(4-chlorophenyl)methyl]benzotriazole nitrate Openeye Name: 6-[(4-chlorophenyl)-imidazol-1-yl-methyl]-1-[(4-chlorophenyl)methyl]benzotriazole nitrate CAS Name: 6-[(4-chlorophenyl)-(1-imidazolyl)methyl]-1-[(4-chlorophenyl)methyl]benzotriazole nitrate IUPAC Name: 6-[(4-chlorophenyl)-imidazol-1-ylmethyl]-1-[(4-chlorophenyl)methyl]benzotriazole nitrate Traditional Name: 1-(4-chlorobenzyl)-6-[(4-chlorophenyl)-imidazol-1-yl-methyl]benzotriazole nitrate Formula: C23H17Cl2N6O3- MolecularWeight: 496.32548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C3=C(C=CC(=C3)C(C4=CC=C(C=C4)Cl)N5C=CN=C5)N=N2)Cl.[N+](=O)([O-])[O-]

Isomeric SMILES

C1=CC(=CC=C1CN2C3=C(C=CC(=C3)C(C4=CC=C(C=C4)Cl)N5C=CN=C5)N=N2)Cl.[N+](=O)([O-])[O-]

InChI

InChI=1S/C23H17Cl2N5.NO3/c24-19-6-1-16(2-7-19)14-30-22-13-18(5-10-21(22)27-28-30)23(29-12-11-26-15-29)17-3-8-20(25)9-4-17;2-1(3)4/h1-13,15,23H,14H2;/q;-1