2-(anthracen-9-ylmethylsulfanyl)-1-oxidanyl-pyridin-1-ium

Systemtic Name: 2-(anthracen-9-ylmethylsulfanyl)-1-oxidanyl-pyridin-1-ium Openeye Name: 2-(9-anthrylmethylsulfanyl)-1-hydroxy-pyridin-1-ium CAS Name: 2-(9-anthracenylmethylthio)-1-hydroxypyridin-1-ium IUPAC Name: 2-(anthracen-9-ylmethylsulfanyl)-1-hydroxypyridin-1-ium Traditional Name: 2-(9-anthrylmethylthio)-1-hydroxy-pyridin-1-ium Formula: C20H16NOS+ MolecularWeight: 318.41214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2CSC4=CC=CC=[N+]4O

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2CSC4=CC=CC=[N+]4O

InChI

InChI=1S/C20H16NOS/c22-21-12-6-5-11-20(21)23-14-19-17-9-3-1-7-15(17)13-16-8-2-4-10-18(16)19/h1-13,22H,14H2/q+1