(3-ethynylphenyl) 4-methylbenzenesulfonate

Systemtic Name: (3-ethynylphenyl) 4-methylbenzenesulfonate Openeye Name: (3-ethynylphenyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (3-ethynylphenyl) ester IUPAC Name: (3-ethynylphenyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (3-ethynylphenyl) ester Formula: C15H12O3S MolecularWeight: 272.31898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)C#C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)C#C

InChI

InChI=1S/C15H12O3S/c1-3-13-5-4-6-14(11-13)18-19(16,17)15-9-7-12(2)8-10-15/h1,4-11H,2H3