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

Systemtic Name: 6-[(4-chlorophenyl)-imidazol-1-yl-methyl]-1-(1-phenylethyl)benzotriazole nitrate Openeye Name: 6-[(4-chlorophenyl)-imidazol-1-yl-methyl]-1-(1-phenylethyl)benzotriazole nitrate CAS Name: 6-[(4-chlorophenyl)-(1-imidazolyl)methyl]-1-(1-phenylethyl)benzotriazole nitrate IUPAC Name: 6-[(4-chlorophenyl)-imidazol-1-ylmethyl]-1-(1-phenylethyl)benzotriazole nitrate Traditional Name: 6-[(4-chlorophenyl)-imidazol-1-yl-methyl]-1-(1-phenylethyl)benzotriazole nitrate Formula: C24H20ClN6O3- MolecularWeight: 475.907

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C1=CC=CC=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/C24H20ClN5.NO3/c1-17(18-5-3-2-4-6-18)30-23-15-20(9-12-22(23)27-28-30)24(29-14-13-26-16-29)19-7-10-21(25)11-8-19;2-1(3)4/h2-17,24H,1H3;/q;-1