(3-ethanoyl-6-methoxy-4-oxidanidyl-quinoxalin-4-ium-2-yl)methyl 2-phenoxyethanoate

Systemtic Name: (3-ethanoyl-6-methoxy-4-oxidanidyl-quinoxalin-4-ium-2-yl)methyl 2-phenoxyethanoate Openeye Name: (3-acetyl-6-methoxy-4-oxido-quinoxalin-4-ium-2-yl)methyl 2-phenoxyacetate CAS Name: 2-phenoxyacetic acid (3-acetyl-6-methoxy-4-oxido-2-quinoxalin-4-iumyl)methyl ester IUPAC Name: (3-acetyl-6-methoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 2-phenoxyacetate Traditional Name: 2-phenoxyacetic acid (3-acetyl-6-methoxy-4-oxido-quinoxalin-4-ium-2-yl)methyl ester Formula: C20H18N2O6 MolecularWeight: 382.36672

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=[N+](C2=C(C=CC(=C2)OC)N=C1COC(=O)COC3=CC=CC=C3)[O-]

Isomeric SMILES

CC(=O)C1=[N+](C2=C(C=CC(=C2)OC)N=C1COC(=O)COC3=CC=CC=C3)[O-]

InChI

InChI=1S/C20H18N2O6/c1-13(23)20-17(11-28-19(24)12-27-14-6-4-3-5-7-14)21-16-9-8-15(26-2)10-18(16)22(20)25/h3-10H,11-12H2,1-2H3