N-[ethoxy-(1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-yl)methyl]pyrimidin-2-amine

Systemtic Name: N-[ethoxy-(1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-yl)methyl]pyrimidin-2-amine Openeye Name: N-[ethoxy-(1-oxido-4-oxo-quinoxalin-4-ium-2-yl)methyl]pyrimidin-2-amine CAS Name: N-[ethoxy-(1-oxido-4-oxo-2-quinoxalin-4-iumyl)methyl]-2-pyrimidinamine IUPAC Name: N-[ethoxy-(1-oxido-4-oxoquinoxalin-4-ium-2-yl)methyl]pyrimidin-2-amine Traditional Name: [ethoxy-(4-keto-1-oxido-quinoxalin-4-ium-2-yl)methyl]-(2-pyrimidyl)amine Formula: C15H15N5O3 MolecularWeight: 313.3113

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=C[N+](=O)C2=CC=CC=C2N1[O-])NC3=NC=CC=N3

Isomeric SMILES

CCOC(C1=C[N+](=O)C2=CC=CC=C2N1[O-])NC3=NC=CC=N3

InChI

InChI=1S/C15H15N5O3/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/h3-10,14H,2H2,1H3,(H,16,17,18)