[4-(3-cyanophenyl)-5-methylsulfonyloxy-pentyl] methanesulfonate

Systemtic Name: [4-(3-cyanophenyl)-5-methylsulfonyloxy-pentyl] methanesulfonate Openeye Name: [4-(3-cyanophenyl)-5-methylsulfonyloxy-pentyl] methanesulfonate CAS Name: methanesulfonic acid [4-(3-cyanophenyl)-5-methylsulfonyloxypentyl] ester IUPAC Name: [4-(3-cyanophenyl)-5-methylsulfonyloxypentyl] methanesulfonate Traditional Name: methanesulfonic acid [4-(3-cyanophenyl)-5-methylsulfonyloxy-pentyl] ester Formula: C14H19NO6S2 MolecularWeight: 361.43376

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCCC(COS(=O)(=O)C)C1=CC=CC(=C1)C#N

Isomeric SMILES

CS(=O)(=O)OCCCC(COS(=O)(=O)C)C1=CC=CC(=C1)C#N

InChI

InChI=1S/C14H19NO6S2/c1-22(16,17)20-8-4-7-14(11-21-23(2,18)19)13-6-3-5-12(9-13)10-15/h3,5-6,9,14H,4,7-8,11H2,1-2H3