2,6-dimethyl-4-[(4-nitrophenyl)methylsulfanyl]pyrylium

Systemtic Name: 2,6-dimethyl-4-[(4-nitrophenyl)methylsulfanyl]pyrylium Openeye Name: 2,6-dimethyl-4-[(4-nitrophenyl)methylsulfanyl]pyrylium CAS Name: 2,6-dimethyl-4-[(4-nitrophenyl)methylthio]pyrylium IUPAC Name: 2,6-dimethyl-4-[(4-nitrophenyl)methylsulfanyl]pyrylium Traditional Name: 2,6-dimethyl-4-[(4-nitrobenzyl)thio]pyrylium Formula: C14H14NO3S+ MolecularWeight: 276.33086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=[O+]1)C)SCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=[O+]1)C)SCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H14NO3S/c1-10-7-14(8-11(2)18-10)19-9-12-3-5-13(6-4-12)15(16)17/h3-8H,9H2,1-2H3/q+1