3-[(3-nitropyridin-2-yl)amino]azepan-2-one

Systemtic Name: 3-[(3-nitropyridin-2-yl)amino]azepan-2-one Openeye Name: 3-[(3-nitro-2-pyridyl)amino]azepan-2-one CAS Name: 3-[(3-nitro-2-pyridinyl)amino]-2-azepanone IUPAC Name: 3-[(3-nitropyridin-2-yl)amino]azepan-2-one Traditional Name: 3-[(3-nitro-2-pyridyl)amino]azepan-2-one Formula: C11H14N4O3 MolecularWeight: 250.25386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC2=C(C=CC=N2)[N+](=O)[O-]

Isomeric SMILES

C1CCNC(=O)C(C1)NC2=C(C=CC=N2)[N+](=O)[O-]

InChI

InChI=1S/C11H14N4O3/c16-11-8(4-1-2-6-13-11)14-10-9(15(17)18)5-3-7-12-10/h3,5,7-8H,1-2,4,6H2,(H,12,14)(H,13,16)