N-(1-adamantyl)-3-azanylidene-1-oxidanidyl-4-oxidanyl-quinoxalin-1-ium-2-carboxamide

Systemtic Name: N-(1-adamantyl)-3-azanylidene-1-oxidanidyl-4-oxidanyl-quinoxalin-1-ium-2-carboxamide Openeye Name: N-(1-adamantyl)-4-hydroxy-3-imino-1-oxido-quinoxalin-1-ium-2-carboxamide CAS Name: N-(1-adamantyl)-4-hydroxy-3-imino-1-oxido-2-quinoxalin-1-iumcarboxamide IUPAC Name: N-(1-adamantyl)-4-hydroxy-3-imino-1-oxidoquinoxalin-1-ium-2-carboxamide Traditional Name: N-(1-adamantyl)-4-hydroxy-3-imino-1-oxido-quinoxalin-1-ium-2-carboxamide Formula: C19H22N4O3 MolecularWeight: 354.40298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=[N+](C5=CC=CC=C5N(C4=N)O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=[N+](C5=CC=CC=C5N(C4=N)O)[O-]

InChI

InChI=1S/C19H22N4O3/c20-17-16(22(25)14-3-1-2-4-15(14)23(17)26)18(24)21-19-8-11-5-12(9-19)7-13(6-11)10-19/h1-4,11-13,20,26H,5-10H2,(H,21,24)