3-(4-methylphenyl)-4-oxidanidyl-1-[(4-phenoxyphenyl)methoxy]quinoxalin-4-ium-2-one

Systemtic Name: 3-(4-methylphenyl)-4-oxidanidyl-1-[(4-phenoxyphenyl)methoxy]quinoxalin-4-ium-2-one Openeye Name: 4-oxido-1-[(4-phenoxyphenyl)methoxy]-3-(p-tolyl)quinoxalin-4-ium-2-one CAS Name: 3-(4-methylphenyl)-4-oxido-1-[(4-phenoxyphenyl)methoxy]-2-quinoxalin-4-iumone IUPAC Name: 3-(4-methylphenyl)-4-oxido-1-[(4-phenoxyphenyl)methoxy]quinoxalin-4-ium-2-one Traditional Name: 4-oxido-1-(4-phenoxybenzyl)oxy-3-(p-tolyl)quinoxalin-4-ium-2-one Formula: C28H22N2O4 MolecularWeight: 450.48528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=[N+](C3=CC=CC=C3N(C2=O)OCC4=CC=C(C=C4)OC5=CC=CC=C5)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=[N+](C3=CC=CC=C3N(C2=O)OCC4=CC=C(C=C4)OC5=CC=CC=C5)[O-]

InChI

InChI=1S/C28H22N2O4/c1-20-11-15-22(16-12-20)27-28(31)30(26-10-6-5-9-25(26)29(27)32)33-19-21-13-17-24(18-14-21)34-23-7-3-2-4-8-23/h2-18H,19H2,1H3