3-methyl-1-[(4-nitrophenyl)methoxy]-4-oxidanidyl-quinoxalin-4-ium-2-one

Systemtic Name: 3-methyl-1-[(4-nitrophenyl)methoxy]-4-oxidanidyl-quinoxalin-4-ium-2-one Openeye Name: 3-methyl-1-[(4-nitrophenyl)methoxy]-4-oxido-quinoxalin-4-ium-2-one CAS Name: 3-methyl-1-[(4-nitrophenyl)methoxy]-4-oxido-2-quinoxalin-4-iumone IUPAC Name: 3-methyl-1-[(4-nitrophenyl)methoxy]-4-oxidoquinoxalin-4-ium-2-one Traditional Name: 3-methyl-1-(4-nitrobenzyl)oxy-4-oxido-quinoxalin-4-ium-2-one Formula: C16H13N3O5 MolecularWeight: 327.29152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC=CC=C2N(C1=O)OCC3=CC=C(C=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

CC1=[N+](C2=CC=CC=C2N(C1=O)OCC3=CC=C(C=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C16H13N3O5/c1-11-16(20)18(15-5-3-2-4-14(15)17(11)21)24-10-12-6-8-13(9-7-12)19(22)23/h2-9H,10H2,1H3