4-(1H-benzimidazol-2-yl)-N-[(3-bromanyl-4-methoxy-phenyl)methyl]aniline

Systemtic Name: 4-(1H-benzimidazol-2-yl)-N-[(3-bromanyl-4-methoxy-phenyl)methyl]aniline Openeye Name: 4-(1H-benzimidazol-2-yl)-N-[(3-bromo-4-methoxy-phenyl)methyl]aniline CAS Name: 4-(1H-benzimidazol-2-yl)-N-[(3-bromo-4-methoxyphenyl)methyl]aniline IUPAC Name: 4-(1H-benzimidazol-2-yl)-N-[(3-bromo-4-methoxyphenyl)methyl]aniline Traditional Name: [4-(1H-benzimidazol-2-yl)phenyl]-(3-bromo-4-methoxy-benzyl)amine Formula: C21H18BrN3O MolecularWeight: 408.29112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=CC=C(C=C2)C3=NC4=CC=CC=C4N3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=CC=C(C=C2)C3=NC4=CC=CC=C4N3)Br

InChI

InChI=1S/C21H18BrN3O/c1-26-20-11-6-14(12-17(20)22)13-23-16-9-7-15(8-10-16)21-24-18-4-2-3-5-19(18)25-21/h2-12,23H,13H2,1H3,(H,24,25)