3-methyl-4-piperidin-1-ylcarbonyl-[1,2,4]triazolo[4,3-a]quinoxalin-10-ium-1-olate

Systemtic Name: 3-methyl-4-piperidin-1-ylcarbonyl-[1,2,4]triazolo[4,3-a]quinoxalin-10-ium-1-olate Openeye Name: 3-methyl-4-(piperidine-1-carbonyl)-[1,2,4]triazolo[4,3-a]quinoxalin-10-ium-1-olate CAS Name: 3-methyl-4-[oxo(1-piperidinyl)methyl]-[1,2,4]triazolo[4,3-a]quinoxalin-10-ium-1-olate IUPAC Name: 3-methyl-4-(piperidine-1-carbonyl)-[1,2,4]triazolo[4,3-a]quinoxalin-10-ium-1-olate Traditional Name: 3-methyl-4-(piperidine-1-carbonyl)-[1,2,4]triazolo[4,3-a]quinoxalin-10-ium-1-olate Formula: C16H17N5O2 MolecularWeight: 311.33848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=[N+](C3=CC=CC=C3N=C2C(=O)N4CCCCC4)C(=N1)[O-]

Isomeric SMILES

CN1C2=[N+](C3=CC=CC=C3N=C2C(=O)N4CCCCC4)C(=N1)[O-]

InChI

InChI=1S/C16H17N5O2/c1-19-14-13(15(22)20-9-5-2-6-10-20)17-11-7-3-4-8-12(11)21(14)16(23)18-19/h3-4,7-8H,2,5-6,9-10H2,1H3