2-[(2,5-dimethylphenyl)-phenyl-methyl]sulfonyl-1-oxidanidyl-pyridin-1-ium

Systemtic Name: 2-[(2,5-dimethylphenyl)-phenyl-methyl]sulfonyl-1-oxidanidyl-pyridin-1-ium Openeye Name: 2-[(2,5-dimethylphenyl)-phenyl-methyl]sulfonyl-1-oxido-pyridin-1-ium CAS Name: 2-[(2,5-dimethylphenyl)-phenylmethyl]sulfonyl-1-oxidopyridin-1-ium IUPAC Name: 2-[(2,5-dimethylphenyl)-phenylmethyl]sulfonyl-1-oxidopyridin-1-ium Traditional Name: 2-[(2,5-dimethylphenyl)-phenyl-methyl]sulfonyl-1-oxido-pyridin-1-ium Formula: C20H19NO3S MolecularWeight: 353.43476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=[N+]3[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C20H19NO3S/c1-15-11-12-16(2)18(14-15)20(17-8-4-3-5-9-17)25(23,24)19-10-6-7-13-21(19)22/h3-14,20H,1-2H3