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

Systemtic Name: 6-chloranyl-2-methyl-1-oxidanidyl-4-phenyl-3-(phenylsulfonyl)quinolin-1-ium Openeye Name: 3-(benzenesulfonyl)-6-chloro-2-methyl-1-oxido-4-phenyl-quinolin-1-ium CAS Name: 3-(benzenesulfonyl)-6-chloro-2-methyl-1-oxido-4-phenylquinolin-1-ium IUPAC Name: 3-(benzenesulfonyl)-6-chloro-2-methyl-1-oxido-4-phenylquinolin-1-ium Traditional Name: 3-besyl-6-chloro-2-methyl-1-oxido-4-phenyl-quinolin-1-ium Formula: C22H16ClNO3S MolecularWeight: 409.88534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=C(C=CC2=[N+]1[O-])Cl)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=C2C=C(C=CC2=[N+]1[O-])Cl)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H16ClNO3S/c1-15-22(28(26,27)18-10-6-3-7-11-18)21(16-8-4-2-5-9-16)19-14-17(23)12-13-20(19)24(15)25/h2-14H,1H3