4-cyano-2-[3-methyl-1,4-bis(oxidanidyl)quinoxalin-1-ium-1-yl]butanamide

Systemtic Name: 4-cyano-2-[3-methyl-1,4-bis(oxidanidyl)quinoxalin-1-ium-1-yl]butanamide Openeye Name: 4-cyano-2-(3-methyl-1,4-dioxido-quinoxalin-1-ium-1-yl)butanamide CAS Name: 4-cyano-2-(3-methyl-1,4-dioxido-1-quinoxalin-1-iumyl)butanamide IUPAC Name: 4-cyano-2-(3-methyl-1,4-dioxidoquinoxalin-1-ium-1-yl)butanamide Traditional Name: 4-cyano-2-(3-methyl-1,4-dioxido-quinoxalin-1-ium-1-yl)butyramide Formula: C14H15N4O3- MolecularWeight: 287.2939

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](C2=CC=CC=C2N1[O-])(C(CCC#N)C(=O)N)[O-]

Isomeric SMILES

CC1=C[N+](C2=CC=CC=C2N1[O-])(C(CCC#N)C(=O)N)[O-]

InChI

InChI=1S/C14H15N4O3/c1-10-9-18(21,13(14(16)19)7-4-8-15)12-6-3-2-5-11(12)17(10)20/h2-3,5-6,9,13H,4,7H2,1H3,(H2,16,19)/q-1