tert-butyl 2-(3-aminocarbonylpyridin-1-ium-1-yl)ethanoate

Systemtic Name: tert-butyl 2-(3-aminocarbonylpyridin-1-ium-1-yl)ethanoate Openeye Name: tert-butyl 2-(3-carbamoylpyridin-1-ium-1-yl)acetate CAS Name: 2-(3-carbamoyl-1-pyridin-1-iumyl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(3-carbamoylpyridin-1-ium-1-yl)acetate Traditional Name: 2-(3-carbamoylpyridin-1-ium-1-yl)acetic acid tert-butyl ester Formula: C12H17N2O3+ MolecularWeight: 237.27498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C[N+]1=CC=CC(=C1)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)C[N+]1=CC=CC(=C1)C(=O)N

InChI

InChI=1S/C12H16N2O3/c1-12(2,3)17-10(15)8-14-6-4-5-9(7-14)11(13)16/h4-7H,8H2,1-3H3,(H-,13,16)/p+1