(2R)-2-[2-[2-(methylazaniumyl)ethyl]benzimidazol-1-yl]butanoate

Systemtic Name: (2R)-2-[2-[2-(methylazaniumyl)ethyl]benzimidazol-1-yl]butanoate Openeye Name: (2R)-2-[2-[2-(methylammonio)ethyl]benzimidazol-1-yl]butanoate CAS Name: (2R)-2-[2-[2-(methylammonio)ethyl]-1-benzimidazolyl]butanoate IUPAC Name: (2R)-2-[2-[2-(methylazaniumyl)ethyl]benzimidazol-1-yl]butanoate Traditional Name: (2R)-2-[2-[2-(methylammonio)ethyl]benzimidazol-1-yl]butyrate Formula: C14H19N3O2 MolecularWeight: 261.31956

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])N1C2=CC=CC=C2N=C1CC[NH2+]C

Isomeric SMILES

CC[C@H](C(=O)[O-])N1C2=CC=CC=C2N=C1CC[NH2+]C

InChI

InChI=1S/C14H19N3O2/c1-3-11(14(18)19)17-12-7-5-4-6-10(12)16-13(17)8-9-15-2/h4-7,11,15H,3,8-9H2,1-2H3,(H,18,19)/t11-/m1/s1