1-methyl-3-phenyl-2H-thiochromen-1-ium

Systemtic Name: 1-methyl-3-phenyl-2H-thiochromen-1-ium Openeye Name: 1-methyl-3-phenyl-2H-thiochromen-1-ium CAS Name: 1-methyl-3-phenyl-2H-1-benzothiopyran-1-ium IUPAC Name: 1-methyl-3-phenyl-2H-thiochromen-1-ium Traditional Name: 1-methyl-3-phenyl-2H-thiochromen-1-ium Formula: C16H15S+ MolecularWeight: 239.3553

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Descriptors Computed from Structure

Canonical SMILES:

C[S+]1CC(=CC2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

C[S+]1CC(=CC2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C16H15S/c1-17-12-15(13-7-3-2-4-8-13)11-14-9-5-6-10-16(14)17/h2-11H,12H2,1H3/q+1