4-ethyl-6-[(E)-2-(1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-yl)ethenyl]pyrimidin-2-amine

Systemtic Name: 4-ethyl-6-[(E)-2-(1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-yl)ethenyl]pyrimidin-2-amine Openeye Name: 4-ethyl-6-[(E)-2-(1-oxido-4-oxo-quinoxalin-4-ium-2-yl)vinyl]pyrimidin-2-amine CAS Name: 4-ethyl-6-[(E)-2-(1-oxido-4-oxo-2-quinoxalin-4-iumyl)ethenyl]-2-pyrimidinamine IUPAC Name: 4-ethyl-6-[(E)-2-(1-oxido-4-oxoquinoxalin-4-ium-2-yl)ethenyl]pyrimidin-2-amine Traditional Name: [4-ethyl-6-[(E)-2-(4-keto-1-oxido-quinoxalin-4-ium-2-yl)vinyl]pyrimidin-2-yl]amine Formula: C16H15N5O2 MolecularWeight: 309.3226

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NC(=C1)C=CC2=C[N+](=O)C3=CC=CC=C3N2[O-])N

Isomeric SMILES

CCC1=NC(=NC(=C1)/C=C/C2=C[N+](=O)C3=CC=CC=C3N2[O-])N

InChI

InChI=1S/C16H15N5O2/c1-2-11-9-12(19-16(17)18-11)7-8-13-10-20(22)14-5-3-4-6-15(14)21(13)23/h3-10H,2H2,1H3,(H2,17,18,19)/b8-7+