2-azanylidene-3-(4-methylphenyl)sulfonyl-4-oxidanidyl-1-oxidanyl-quinoxalin-4-ium-6-carbaldehyde

Systemtic Name: 2-azanylidene-3-(4-methylphenyl)sulfonyl-4-oxidanidyl-1-oxidanyl-quinoxalin-4-ium-6-carbaldehyde Openeye Name: 1-hydroxy-2-imino-4-oxido-3-(p-tolylsulfonyl)quinoxalin-4-ium-6-carbaldehyde CAS Name: 1-hydroxy-2-imino-3-(4-methylphenyl)sulfonyl-4-oxido-6-quinoxalin-4-iumcarboxaldehyde IUPAC Name: 1-hydroxy-2-imino-3-(4-methylphenyl)sulfonyl-4-oxidoquinoxalin-4-ium-6-carbaldehyde Traditional Name: 1-hydroxy-2-imino-4-oxido-3-tosyl-quinoxalin-4-ium-6-carbaldehyde Formula: C16H13N3O5S MolecularWeight: 359.35652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N3O5S/c1-10-2-5-12(6-3-10)25(23,24)16-15(17)18(21)13-7-4-11(9-20)8-14(13)19(16)22/h2-9,17,21H,1H3