2-(3-oxidanylidene-2,4-dihydro-1H-quinoxalin-2-yl)-N-(pyridin-1-ium-3-ylmethyl)ethanamide

Systemtic Name: 2-(3-oxidanylidene-2,4-dihydro-1H-quinoxalin-2-yl)-N-(pyridin-1-ium-3-ylmethyl)ethanamide Openeye Name: 2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)-N-(pyridin-1-ium-3-ylmethyl)acetamide CAS Name: 2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)-N-(3-pyridin-1-iumylmethyl)acetamide IUPAC Name: 2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)-N-(pyridin-1-ium-3-ylmethyl)acetamide Traditional Name: 2-(3-keto-2,4-dihydro-1H-quinoxalin-2-yl)-N-(pyridin-1-ium-3-ylmethyl)acetamide Formula: C16H17N4O2+ MolecularWeight: 297.33178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(C(=O)N2)CC(=O)NCC3=C[NH+]=CC=C3

Isomeric SMILES

C1=CC=C2C(=C1)NC(C(=O)N2)CC(=O)NCC3=C[NH+]=CC=C3

InChI

InChI=1S/C16H16N4O2/c21-15(18-10-11-4-3-7-17-9-11)8-14-16(22)20-13-6-2-1-5-12(13)19-14/h1-7,9,14,19H,8,10H2,(H,18,21)(H,20,22)/p+1