2-methyl-1-oxidanidyl-4-[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]sulfonyl-quinolin-1-ium

Systemtic Name: 2-methyl-1-oxidanidyl-4-[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]sulfonyl-quinolin-1-ium Openeye Name: 2-methyl-1-oxido-4-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]sulfonyl-quinolin-1-ium CAS Name: 2-methyl-1-oxido-4-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]sulfonylquinolin-1-ium IUPAC Name: 2-methyl-1-oxido-4-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]sulfonylquinolin-1-ium Traditional Name: 2-methyl-1-oxido-4-[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]sulfonyl-quinolin-1-ium Formula: C23H17N5O3S MolecularWeight: 443.47778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC=CC=C2C(=C1)S(=O)(=O)C3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5)[O-]

Isomeric SMILES

CC1=[N+](C2=CC=CC=C2C(=C1)S(=O)(=O)C3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5)[O-]

InChI

InChI=1S/C23H17N5O3S/c1-15-14-22(20-8-4-5-9-21(20)28(15)29)32(30,31)17-12-10-16(11-13-17)18-6-2-3-7-19(18)23-24-26-27-25-23/h2-14H,1H3,(H,24,25,26,27)