3-(3-methylbut-2-enoyl)-4-oxidanidyl-quinoxalin-4-ium-2-carboxylic acid

Systemtic Name: 3-(3-methylbut-2-enoyl)-4-oxidanidyl-quinoxalin-4-ium-2-carboxylic acid Openeye Name: 3-(3-methylbut-2-enoyl)-4-oxido-quinoxalin-4-ium-2-carboxylic acid CAS Name: 3-(3-methyl-1-oxobut-2-enyl)-4-oxido-2-quinoxalin-4-iumcarboxylic acid IUPAC Name: 3-(3-methylbut-2-enoyl)-4-oxidoquinoxalin-4-ium-2-carboxylic acid Traditional Name: 3-(3-methylbut-2-enoyl)-4-oxido-quinoxalin-4-ium-2-carboxylic acid Formula: C14H12N2O4 MolecularWeight: 272.25608

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C1=[N+](C2=CC=CC=C2N=C1C(=O)O)[O-])C

Isomeric SMILES

CC(=CC(=O)C1=[N+](C2=CC=CC=C2N=C1C(=O)O)[O-])C

InChI

InChI=1S/C14H12N2O4/c1-8(2)7-11(17)13-12(14(18)19)15-9-5-3-4-6-10(9)16(13)20/h3-7H,1-2H3,(H,18,19)