(6S)-8-(5-nitropyridin-2-yl)-6-pyridin-4-yl-8-azabicyclo[3.2.1]oct-3-en-2-one

Systemtic Name: (6S)-8-(5-nitropyridin-2-yl)-6-pyridin-4-yl-8-azabicyclo[3.2.1]oct-3-en-2-one Openeye Name: (6S)-8-(5-nitro-2-pyridyl)-6-(4-pyridyl)-8-azabicyclo[3.2.1]oct-3-en-2-one CAS Name: (6S)-8-(5-nitro-2-pyridinyl)-6-pyridin-4-yl-8-azabicyclo[3.2.1]oct-3-en-2-one IUPAC Name: (6S)-8-(5-nitropyridin-2-yl)-6-pyridin-4-yl-8-azabicyclo[3.2.1]oct-3-en-2-one Traditional Name: (6S)-8-(5-nitro-2-pyridyl)-6-(4-pyridyl)-8-azabicyclo[3.2.1]oct-3-en-2-one Formula: C17H14N4O3 MolecularWeight: 322.31806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C2C=CC(=O)C1N2C3=NC=C(C=C3)[N+](=O)[O-])C4=CC=NC=C4

Isomeric SMILES

C1[C@H](C2C=CC(=O)C1N2C3=NC=C(C=C3)[N+](=O)[O-])C4=CC=NC=C4

InChI

InChI=1S/C17H14N4O3/c22-16-3-2-14-13(11-5-7-18-8-6-11)9-15(16)20(14)17-4-1-12(10-19-17)21(23)24/h1-8,10,13-15H,9H2/t13-,14?,15?/m0/s1