[6-methoxy-4-oxidanidyl-3-(phenylcarbonyl)quinoxalin-4-ium-2-yl]methyl oxolane-2-carboxylate

Systemtic Name: [6-methoxy-4-oxidanidyl-3-(phenylcarbonyl)quinoxalin-4-ium-2-yl]methyl oxolane-2-carboxylate Openeye Name: (3-benzoyl-6-methoxy-4-oxido-quinoxalin-4-ium-2-yl)methyl tetrahydrofuran-2-carboxylate CAS Name: 2-oxolanecarboxylic acid (3-benzoyl-6-methoxy-4-oxido-2-quinoxalin-4-iumyl)methyl ester IUPAC Name: (3-benzoyl-6-methoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl oxolane-2-carboxylate Traditional Name: tetrahydrofuran-2-carboxylic acid (3-benzoyl-6-methoxy-4-oxido-quinoxalin-4-ium-2-yl)methyl ester Formula: C22H20N2O6 MolecularWeight: 408.404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C(=[N+]2[O-])C(=O)C3=CC=CC=C3)COC(=O)C4CCCO4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C(=[N+]2[O-])C(=O)C3=CC=CC=C3)COC(=O)C4CCCO4

InChI

InChI=1S/C22H20N2O6/c1-28-15-9-10-16-18(12-15)24(27)20(21(25)14-6-3-2-4-7-14)17(23-16)13-30-22(26)19-8-5-11-29-19/h2-4,6-7,9-10,12,19H,5,8,11,13H2,1H3