benzo[f][1]benzothiol-4-yl 4-methylbenzenesulfonate

Systemtic Name: benzo[f][1]benzothiol-4-yl 4-methylbenzenesulfonate Openeye Name: benzo[f]benzothiophen-4-yl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 4-benzo[f][1]benzothiolyl ester IUPAC Name: benzo[f][1]benzothiol-4-yl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid benzo[f]benzothiophen-4-yl ester Formula: C19H14O3S2 MolecularWeight: 354.44266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C3C=CSC3=CC4=CC=CC=C42

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C3C=CSC3=CC4=CC=CC=C42

InChI

InChI=1S/C19H14O3S2/c1-13-6-8-15(9-7-13)24(20,21)22-19-16-5-3-2-4-14(16)12-18-17(19)10-11-23-18/h2-12H,1H3