(3E)-1-ethyl-6-methyl-4-oxidanidyl-3-pyrrol-2-ylidene-2H-pyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-dione

Systemtic Name: (3E)-1-ethyl-6-methyl-4-oxidanidyl-3-pyrrol-2-ylidene-2H-pyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-dione Openeye Name: (3E)-1-ethyl-6-methyl-4-oxido-3-pyrrol-2-ylidene-2H-pyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-dione CAS Name: (3E)-1-ethyl-6-methyl-4-oxido-3-(2-pyrrolylidene)-2H-pyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-dione IUPAC Name: (3E)-1-ethyl-6-methyl-4-oxido-3-pyrrol-2-ylidene-2H-pyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-dione Traditional Name: (3E)-1-ethyl-6-methyl-4-oxido-3-pyrrol-2-ylidene-2H-pyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-quinone Formula: C12H12N6O3 MolecularWeight: 288.26208

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC(=O)N(C(=O)C2=[N+](C(=C3C=CC=N3)N1)[O-])C

Isomeric SMILES

CCN1C2=NC(=O)N(C(=O)C2=[N+](/C(=C/3\C=CC=N3)/N1)[O-])C

InChI

InChI=1S/C12H12N6O3/c1-3-17-10-8(11(19)16(2)12(20)14-10)18(21)9(15-17)7-5-4-6-13-7/h4-6,15H,3H2,1-2H3/b9-7+