(2R)-2-azaniumyl-3-[1-(phenylmethyl)imidazol-4-yl]propanoate

Systemtic Name: (2R)-2-azaniumyl-3-[1-(phenylmethyl)imidazol-4-yl]propanoate Openeye Name: (2R)-2-azaniumyl-3-(1-benzylimidazol-4-yl)propanoate CAS Name: (2R)-2-ammonio-3-[1-(phenylmethyl)-4-imidazolyl]propanoate IUPAC Name: (2R)-2-azaniumyl-3-(1-benzylimidazol-4-yl)propanoate Traditional Name: (2R)-2-ammonio-3-(1-benzylimidazol-4-yl)propionate Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(N=C2)CC(C(=O)[O-])[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(N=C2)C[C@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C13H15N3O2/c14-12(13(17)18)6-11-8-16(9-15-11)7-10-4-2-1-3-5-10/h1-5,8-9,12H,6-7,14H2,(H,17,18)/t12-/m1/s1