(2R)-2-[2-(4-aminophenyl)-3H-benzimidazol-1-ium-1-yl]propanoic acid

Systemtic Name: (2R)-2-[2-(4-aminophenyl)-3H-benzimidazol-1-ium-1-yl]propanoic acid Openeye Name: (2R)-2-[2-(4-aminophenyl)-3H-benzimidazol-1-ium-1-yl]propanoic acid CAS Name: (2R)-2-[2-(4-aminophenyl)-3H-benzimidazol-1-ium-1-yl]propanoic acid IUPAC Name: (2R)-2-[2-(4-aminophenyl)-3H-benzimidazol-1-ium-1-yl]propanoic acid Traditional Name: (2R)-2-[2-(4-aminophenyl)-3H-benzimidazol-1-ium-1-yl]propionic acid Formula: C16H16N3O2+ MolecularWeight: 282.31714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)[N+]1=C(NC2=CC=CC=C21)C3=CC=C(C=C3)N

Isomeric SMILES

C[C@H](C(=O)O)[N+]1=C(NC2=CC=CC=C21)C3=CC=C(C=C3)N

InChI

InChI=1S/C16H15N3O2/c1-10(16(20)21)19-14-5-3-2-4-13(14)18-15(19)11-6-8-12(17)9-7-11/h2-10H,1H3,(H3,17,18,20,21)/p+1/t10-/m1/s1