1-(4-chlorophenyl)-2-methyl-1H-isothiochromen-2-ium

Systemtic Name: 1-(4-chlorophenyl)-2-methyl-1H-isothiochromen-2-ium Openeye Name: 1-(4-chlorophenyl)-2-methyl-1H-isothiochromen-2-ium CAS Name: 1-(4-chlorophenyl)-2-methyl-1H-2-benzothiopyran-2-ium IUPAC Name: 1-(4-chlorophenyl)-2-methyl-1H-isothiochromen-2-ium Traditional Name: 1-(4-chlorophenyl)-2-methyl-1H-isothiochromen-2-ium Formula: C16H14ClS+ MolecularWeight: 273.80036

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Descriptors Computed from Structure

Canonical SMILES:

C[S+]1C=CC2=CC=CC=C2C1C3=CC=C(C=C3)Cl

Isomeric SMILES

C[S+]1C=CC2=CC=CC=C2C1C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H14ClS/c1-18-11-10-12-4-2-3-5-15(12)16(18)13-6-8-14(17)9-7-13/h2-11,16H,1H3/q+1