6-piperidin-1-ylhexyl 4-methylbenzenesulfonate

Systemtic Name: 6-piperidin-1-ylhexyl 4-methylbenzenesulfonate Openeye Name: 6-(1-piperidyl)hexyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 6-(1-piperidinyl)hexyl ester IUPAC Name: 6-piperidin-1-ylhexyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 6-piperidinohexyl ester Formula: C18H29NO3S MolecularWeight: 339.49276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCN2CCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCN2CCCCC2

InChI

InChI=1S/C18H29NO3S/c1-17-9-11-18(12-10-17)23(20,21)22-16-8-3-2-5-13-19-14-6-4-7-15-19/h9-12H,2-8,13-16H2,1H3