5-oxidanylidene-1-(pyridin-4-ylmethyl)-4aH-pyrido[3,2-b]quinoxalin-5-ium-2-imine

Systemtic Name: 5-oxidanylidene-1-(pyridin-4-ylmethyl)-4aH-pyrido[3,2-b]quinoxalin-5-ium-2-imine Openeye Name: 5-oxo-1-(4-pyridylmethyl)-4aH-pyrido[3,2-b]quinoxalin-5-ium-2-imine CAS Name: 5-oxo-1-(pyridin-4-ylmethyl)-4aH-pyrido[3,2-b]quinoxalin-5-ium-2-imine IUPAC Name: 5-oxo-1-(pyridin-4-ylmethyl)-4aH-pyrido[3,2-b]quinoxalin-5-ium-2-imine Traditional Name: [5-keto-1-(4-pyridylmethyl)-4aH-pyrido[3,2-b]quinoxalin-5-ium-2-ylidene]amine Formula: C17H14N5O+ MolecularWeight: 304.32596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C3C([N+]2=O)C=CC(=N)N3CC4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)N=C3C([N+]2=O)C=CC(=N)N3CC4=CC=NC=C4

InChI

InChI=1S/C17H14N5O/c18-16-6-5-15-17(21(16)11-12-7-9-19-10-8-12)20-13-3-1-2-4-14(13)22(15)23/h1-10,15,18H,11H2/q+1