(2R)-2-azaniumyl-4-(1H-benzimidazol-2-yl)butanoate

Systemtic Name: (2R)-2-azaniumyl-4-(1H-benzimidazol-2-yl)butanoate Openeye Name: (2R)-2-azaniumyl-4-(1H-benzimidazol-2-yl)butanoate CAS Name: (2R)-2-ammonio-4-(1H-benzimidazol-2-yl)butanoate IUPAC Name: (2R)-2-azaniumyl-4-(1H-benzimidazol-2-yl)butanoate Traditional Name: (2R)-2-ammonio-4-(1H-benzimidazol-2-yl)butyrate Formula: C11H13N3O2 MolecularWeight: 219.23982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CCC(C(=O)[O-])[NH3+]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CC[C@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C11H13N3O2/c12-7(11(15)16)5-6-10-13-8-3-1-2-4-9(8)14-10/h1-4,7H,5-6,12H2,(H,13,14)(H,15,16)/t7-/m1/s1