2-[(1-phenylmethoxycarbonylpyridin-1-ium-2-yl)amino]propanoic acid

Systemtic Name: 2-[(1-phenylmethoxycarbonylpyridin-1-ium-2-yl)amino]propanoic acid Openeye Name: 2-[(1-benzyloxycarbonylpyridin-1-ium-2-yl)amino]propanoic acid CAS Name: 2-[(1-phenylmethoxycarbonyl-2-pyridin-1-iumyl)amino]propanoic acid IUPAC Name: 2-[(1-phenylmethoxycarbonylpyridin-1-ium-2-yl)amino]propanoic acid Traditional Name: 2-[(1-carbobenzoxypyridin-1-ium-2-yl)amino]propionic acid Formula: C16H17N2O4+ MolecularWeight: 301.31718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC1=CC=CC=[N+]1C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)O)NC1=CC=CC=[N+]1C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H16N2O4/c1-12(15(19)20)17-14-9-5-6-10-18(14)16(21)22-11-13-7-3-2-4-8-13/h2-10,12H,11H2,1H3,(H,19,20)/p+1