benzotriazol-1-yl 2-[(4-bromophenyl)methyl]-7-methoxy-1H-benzimidazole-4-carboxylate

Systemtic Name: benzotriazol-1-yl 2-[(4-bromophenyl)methyl]-7-methoxy-1H-benzimidazole-4-carboxylate Openeye Name: benzotriazol-1-yl 2-[(4-bromophenyl)methyl]-7-methoxy-1H-benzimidazole-4-carboxylate CAS Name: 2-[(4-bromophenyl)methyl]-7-methoxy-1H-benzimidazole-4-carboxylic acid 1-benzotriazolyl ester IUPAC Name: benzotriazol-1-yl 2-[(4-bromophenyl)methyl]-7-methoxy-1H-benzimidazole-4-carboxylate Traditional Name: 2-(4-bromobenzyl)-7-methoxy-1H-benzimidazole-4-carboxylic acid benzotriazol-1-yl ester Formula: C22H16BrN5O3 MolecularWeight: 478.29814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C(=O)ON3C4=CC=CC=C4N=N3)N=C(N2)CC5=CC=C(C=C5)Br

Isomeric SMILES

COC1=C2C(=C(C=C1)C(=O)ON3C4=CC=CC=C4N=N3)N=C(N2)CC5=CC=C(C=C5)Br

InChI

InChI=1S/C22H16BrN5O3/c1-30-18-11-10-15(22(29)31-28-17-5-3-2-4-16(17)26-27-28)20-21(18)25-19(24-20)12-13-6-8-14(23)9-7-13/h2-11H,12H2,1H3,(H,24,25)