[4-oxidanidyl-3-(phenylcarbonyl)quinoxalin-4-ium-2-yl]methyl 2-methylpropanoate

Systemtic Name: [4-oxidanidyl-3-(phenylcarbonyl)quinoxalin-4-ium-2-yl]methyl 2-methylpropanoate Openeye Name: (3-benzoyl-4-oxido-quinoxalin-4-ium-2-yl)methyl 2-methylpropanoate CAS Name: 2-methylpropanoic acid (3-benzoyl-4-oxido-2-quinoxalin-4-iumyl)methyl ester IUPAC Name: (3-benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 2-methylpropanoate Traditional Name: 2-methylpropionic acid (3-benzoyl-4-oxido-quinoxalin-4-ium-2-yl)methyl ester Formula: C20H18N2O4 MolecularWeight: 350.36792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OCC1=NC2=CC=CC=C2[N+](=C1C(=O)C3=CC=CC=C3)[O-]

Isomeric SMILES

CC(C)C(=O)OCC1=NC2=CC=CC=C2[N+](=C1C(=O)C3=CC=CC=C3)[O-]

InChI

InChI=1S/C20H18N2O4/c1-13(2)20(24)26-12-16-18(19(23)14-8-4-3-5-9-14)22(25)17-11-7-6-10-15(17)21-16/h3-11,13H,12H2,1-2H3