(2R)-2-[2-[4-(azaniumylmethyl)phenyl]benzimidazol-1-yl]propanoate

Systemtic Name: (2R)-2-[2-[4-(azaniumylmethyl)phenyl]benzimidazol-1-yl]propanoate Openeye Name: (2R)-2-[2-[4-(azaniumylmethyl)phenyl]benzimidazol-1-yl]propanoate CAS Name: (2R)-2-[2-[4-(ammoniomethyl)phenyl]-1-benzimidazolyl]propanoate IUPAC Name: (2R)-2-[2-[4-(azaniumylmethyl)phenyl]benzimidazol-1-yl]propanoate Traditional Name: (2R)-2-[2-[4-(ammoniomethyl)phenyl]benzimidazol-1-yl]propionate Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])N1C2=CC=CC=C2N=C1C3=CC=C(C=C3)C[NH3+]

Isomeric SMILES

C[C@H](C(=O)[O-])N1C2=CC=CC=C2N=C1C3=CC=C(C=C3)C[NH3+]

InChI

InChI=1S/C17H17N3O2/c1-11(17(21)22)20-15-5-3-2-4-14(15)19-16(20)13-8-6-12(10-18)7-9-13/h2-9,11H,10,18H2,1H3,(H,21,22)/t11-/m1/s1