(4-methyl-2-sulfanylidene-chromen-7-yl) 4-methylbenzenesulfonate

Systemtic Name: (4-methyl-2-sulfanylidene-chromen-7-yl) 4-methylbenzenesulfonate Openeye Name: (4-methyl-2-thioxo-chromen-7-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (4-methyl-2-sulfanylidene-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-sulfanylidenechromen-7-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-methyl-2-thioxo-chromen-7-yl) ester Formula: C17H14O4S2 MolecularWeight: 346.42066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C(=CC(=S)O3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C(=CC(=S)O3)C

InChI

InChI=1S/C17H14O4S2/c1-11-3-6-14(7-4-11)23(18,19)21-13-5-8-15-12(2)9-17(22)20-16(15)10-13/h3-10H,1-2H3