3,3-dimethyl-4-(4-oxidanidylquinoxalin-4-ium-2-yl)butanoic acid

Systemtic Name: 3,3-dimethyl-4-(4-oxidanidylquinoxalin-4-ium-2-yl)butanoic acid Openeye Name: 3,3-dimethyl-4-(4-oxidoquinoxalin-4-ium-2-yl)butanoic acid CAS Name: 3,3-dimethyl-4-(4-oxido-2-quinoxalin-4-iumyl)butanoic acid IUPAC Name: 3,3-dimethyl-4-(4-oxidoquinoxalin-4-ium-2-yl)butanoic acid Traditional Name: 3,3-dimethyl-4-(4-oxidoquinoxalin-4-ium-2-yl)butyric acid Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=NC2=CC=CC=C2[N+](=C1)[O-])CC(=O)O

Isomeric SMILES

CC(C)(CC1=NC2=CC=CC=C2[N+](=C1)[O-])CC(=O)O

InChI

InChI=1S/C14H16N2O3/c1-14(2,8-13(17)18)7-10-9-16(19)12-6-4-3-5-11(12)15-10/h3-6,9H,7-8H2,1-2H3,(H,17,18)