(4-azanylcyclohexyl) 4-methylbenzenesulfonate

Systemtic Name: (4-azanylcyclohexyl) 4-methylbenzenesulfonate Openeye Name: (4-aminocyclohexyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (4-aminocyclohexyl) ester IUPAC Name: (4-aminocyclohexyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-aminocyclohexyl) ester Formula: C13H19NO3S MolecularWeight: 269.35986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO3S/c1-10-2-8-13(9-3-10)18(15,16)17-12-6-4-11(14)5-7-12/h2-3,8-9,11-12H,4-7,14H2,1H3