tert-butyl N-(6-chloranyl-1-oxidanidyl-pyridin-1-ium-2-yl)-N-ethanoyl-carbamate

Systemtic Name: tert-butyl N-(6-chloranyl-1-oxidanidyl-pyridin-1-ium-2-yl)-N-ethanoyl-carbamate Openeye Name: tert-butyl N-acetyl-N-(6-chloro-1-oxido-pyridin-1-ium-2-yl)carbamate CAS Name: N-acetyl-N-(6-chloro-1-oxido-2-pyridin-1-iumyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-acetyl-N-(6-chloro-1-oxidopyridin-1-ium-2-yl)carbamate Traditional Name: N-acetyl-N-(6-chloro-1-oxido-pyridin-1-ium-2-yl)carbamic acid tert-butyl ester Formula: C12H15ClN2O4 MolecularWeight: 286.7115

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15ClN2O4/c1-8(16)14(11(17)19-12(2,3)4)10-7-5-6-9(13)15(10)18/h5-7H,1-4H3