ethyl N-[4-azanyl-5-nitro-6-(2-oxidanylidenepropylamino)pyridin-2-yl]carbamate hydrobromide

Systemtic Name: ethyl N-[4-azanyl-5-nitro-6-(2-oxidanylidenepropylamino)pyridin-2-yl]carbamate hydrobromide Openeye Name: ethyl N-[6-(acetonylamino)-4-amino-5-nitro-2-pyridyl]carbamate hydrobromide CAS Name: N-[4-amino-5-nitro-6-(2-oxopropylamino)-2-pyridinyl]carbamic acid ethyl ester hydrobromide IUPAC Name: ethyl N-[4-amino-5-nitro-6-(2-oxopropylamino)pyridin-2-yl]carbamate hydrobromide Traditional Name: N-[6-(acetonylamino)-4-amino-5-nitro-2-pyridyl]carbamic acid ethyl ester hydrobromide Formula: C11H16BrN5O5 MolecularWeight: 378.17924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=NC(=C(C(=C1)N)[N+](=O)[O-])NCC(=O)C.Br

Isomeric SMILES

CCOC(=O)NC1=NC(=C(C(=C1)N)[N+](=O)[O-])NCC(=O)C.Br

InChI

InChI=1S/C11H15N5O5.BrH/c1-3-21-11(18)15-8-4-7(12)9(16(19)20)10(14-8)13-5-6(2)17;/h4H,3,5H2,1-2H3,(H4,12,13,14,15,18);1H