ethyl (2E)-1-oxidanidyl-4-oxidanylidene-N-pyrimidin-2-yl-quinoxalin-4-ium-2-carboximidate

Systemtic Name: ethyl (2E)-1-oxidanidyl-4-oxidanylidene-N-pyrimidin-2-yl-quinoxalin-4-ium-2-carboximidate Openeye Name: ethyl (2E)-1-oxido-4-oxo-N-pyrimidin-2-yl-quinoxalin-4-ium-2-carboximidate CAS Name: (2E)-1-oxido-4-oxo-N-(2-pyrimidinyl)-2-quinoxalin-4-iumcarboximidic acid ethyl ester IUPAC Name: ethyl (2E)-1-oxido-4-oxo-N-pyrimidin-2-ylquinoxalin-4-ium-2-carboximidate Traditional Name: (2E)-4-keto-1-oxido-N-(2-pyrimidyl)quinoxalin-4-ium-2-carboximidic acid ethyl ester Formula: C15H13N5O3 MolecularWeight: 311.29542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=NC1=NC=CC=N1)C2=C[N+](=O)C3=CC=CC=C3N2[O-]

Isomeric SMILES

CCO/C(=N/C1=NC=CC=N1)/C2=C[N+](=O)C3=CC=CC=C3N2[O-]

InChI

InChI=1S/C15H13N5O3/c1-2-23-14(18-15-16-8-5-9-17-15)13-10-19(21)11-6-3-4-7-12(11)20(13)22/h3-10H,2H2,1H3/b18-14+