4-[[2-(3-azanyl-4-methyl-phenyl)benzimidazol-1-yl]methyl]benzoate

Systemtic Name: 4-[[2-(3-azanyl-4-methyl-phenyl)benzimidazol-1-yl]methyl]benzoate Openeye Name: 4-[[2-(3-amino-4-methyl-phenyl)benzimidazol-1-yl]methyl]benzoate CAS Name: 4-[[2-(3-amino-4-methylphenyl)-1-benzimidazolyl]methyl]benzoate IUPAC Name: 4-[[2-(3-amino-4-methylphenyl)benzimidazol-1-yl]methyl]benzoate Traditional Name: 4-[[2-(3-amino-4-methyl-phenyl)benzimidazol-1-yl]methyl]benzoate Formula: C22H18N3O2- MolecularWeight: 356.39722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)C(=O)[O-])N

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)C(=O)[O-])N

InChI

InChI=1S/C22H19N3O2/c1-14-6-9-17(12-18(14)23)21-24-19-4-2-3-5-20(19)25(21)13-15-7-10-16(11-8-15)22(26)27/h2-12H,13,23H2,1H3,(H,26,27)/p-1