6-chloranyl-1-oxidanidyl-4-phenyl-3-(phenylsulfonyl)quinolin-1-ium-2-carbaldehyde

Systemtic Name: 6-chloranyl-1-oxidanidyl-4-phenyl-3-(phenylsulfonyl)quinolin-1-ium-2-carbaldehyde Openeye Name: 3-(benzenesulfonyl)-6-chloro-1-oxido-4-phenyl-quinolin-1-ium-2-carbaldehyde CAS Name: 3-(benzenesulfonyl)-6-chloro-1-oxido-4-phenyl-2-quinolin-1-iumcarboxaldehyde IUPAC Name: 3-(benzenesulfonyl)-6-chloro-1-oxido-4-phenylquinolin-1-ium-2-carbaldehyde Traditional Name: 3-besyl-6-chloro-1-oxido-4-phenyl-quinolin-1-ium-2-carbaldehyde Formula: C22H14ClNO4S MolecularWeight: 423.86886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C(C=CC3=[N+](C(=C2S(=O)(=O)C4=CC=CC=C4)C=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C(C=CC3=[N+](C(=C2S(=O)(=O)C4=CC=CC=C4)C=O)[O-])Cl

InChI

InChI=1S/C22H14ClNO4S/c23-16-11-12-19-18(13-16)21(15-7-3-1-4-8-15)22(20(14-25)24(19)26)29(27,28)17-9-5-2-6-10-17/h1-14H