(4-cyanophenyl) 4,5-dimethoxy-2-methyl-benzenesulfonate

Systemtic Name: (4-cyanophenyl) 4,5-dimethoxy-2-methyl-benzenesulfonate Openeye Name: (4-cyanophenyl) 4,5-dimethoxy-2-methyl-benzenesulfonate CAS Name: 4,5-dimethoxy-2-methylbenzenesulfonic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 4,5-dimethoxy-2-methylbenzenesulfonate Traditional Name: 4,5-dimethoxy-2-methyl-benzenesulfonic acid (4-cyanophenyl) ester Formula: C16H15NO5S MolecularWeight: 333.359

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1S(=O)(=O)OC2=CC=C(C=C2)C#N)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1S(=O)(=O)OC2=CC=C(C=C2)C#N)OC)OC

InChI

InChI=1S/C16H15NO5S/c1-11-8-14(20-2)15(21-3)9-16(11)23(18,19)22-13-6-4-12(10-17)5-7-13/h4-9H,1-3H3