ethanedioate; 6-[imidazol-1-yl(phenyl)methyl]-1-propan-2-yl-benzotriazole

Systemtic Name: ethanedioate; 6-[imidazol-1-yl(phenyl)methyl]-1-propan-2-yl-benzotriazole Openeye Name: 6-[imidazol-1-yl(phenyl)methyl]-1-isopropyl-benzotriazole; oxalate CAS Name: 6-[1-imidazolyl(phenyl)methyl]-1-propan-2-ylbenzotriazole; oxalate IUPAC Name: 6-[imidazol-1-yl(phenyl)methyl]-1-propan-2-ylbenzotriazole; oxalate Traditional Name: 6-[imidazol-1-yl(phenyl)methyl]-1-isopropyl-benzotriazole; oxalate Formula: C21H19N5O4-2 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=CC(=C2)C(C3=CC=CC=C3)N4C=CN=C4)N=N1.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

CC(C)N1C2=C(C=CC(=C2)C(C3=CC=CC=C3)N4C=CN=C4)N=N1.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C19H19N5.C2H2O4/c1-14(2)24-18-12-16(8-9-17(18)21-22-24)19(23-11-10-20-13-23)15-6-4-3-5-7-15;3-1(4)2(5)6/h3-14,19H,1-2H3;(H,3,4)(H,5,6)/p-2