4-(1H-benzimidazol-2-ylmethylamino)benzoic acid

Systemtic Name: 4-(1H-benzimidazol-2-ylmethylamino)benzoic acid Openeye Name: 4-(1H-benzimidazol-2-ylmethylamino)benzoic acid CAS Name: 4-(1H-benzimidazol-2-ylmethylamino)benzoic acid IUPAC Name: 4-(1H-benzimidazol-2-ylmethylamino)benzoic acid Traditional Name: 4-(1H-benzimidazol-2-ylmethylamino)benzoic acid Formula: C15H13N3O2 MolecularWeight: 267.28262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CNC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CNC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C15H13N3O2/c19-15(20)10-5-7-11(8-6-10)16-9-14-17-12-3-1-2-4-13(12)18-14/h1-8,16H,9H2,(H,17,18)(H,19,20)