(4-acetamidocyclohexyl) 4-methylbenzenesulfonate

Systemtic Name: (4-acetamidocyclohexyl) 4-methylbenzenesulfonate Openeye Name: (4-acetamidocyclohexyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (4-acetamidocyclohexyl) ester IUPAC Name: (4-acetamidocyclohexyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-acetamidocyclohexyl) ester Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CCC(CC2)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CCC(CC2)NC(=O)C

InChI

InChI=1S/C15H21NO4S/c1-11-3-9-15(10-4-11)21(18,19)20-14-7-5-13(6-8-14)16-12(2)17/h3-4,9-10,13-14H,5-8H2,1-2H3,(H,16,17)