ethyl N-[6-azanyl-5-nitro-4-(3-oxidanylideneheptan-2-ylamino)pyridin-2-yl]carbamate

Systemtic Name: ethyl N-[6-azanyl-5-nitro-4-(3-oxidanylideneheptan-2-ylamino)pyridin-2-yl]carbamate Openeye Name: ethyl N-[6-amino-4-[(1-methyl-2-oxo-hexyl)amino]-5-nitro-2-pyridyl]carbamate CAS Name: N-[6-amino-5-nitro-4-(3-oxoheptan-2-ylamino)-2-pyridinyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[6-amino-5-nitro-4-(3-oxoheptan-2-ylamino)pyridin-2-yl]carbamate Traditional Name: N-[6-amino-4-[(2-keto-1-methyl-hexyl)amino]-5-nitro-2-pyridyl]carbamic acid ethyl ester Formula: C15H23N5O5 MolecularWeight: 353.37362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C(C)NC1=CC(=NC(=C1[N+](=O)[O-])N)NC(=O)OCC

Isomeric SMILES

CCCCC(=O)C(C)NC1=CC(=NC(=C1[N+](=O)[O-])N)NC(=O)OCC

InChI

InChI=1S/C15H23N5O5/c1-4-6-7-11(21)9(3)17-10-8-12(19-15(22)25-5-2)18-14(16)13(10)20(23)24/h8-9H,4-7H2,1-3H3,(H4,16,17,18,19,22)