[2-methyl-1-(3-pyridin-3-ylpropyl)piperidin-2-yl] benzenesulfonate

Systemtic Name: [2-methyl-1-(3-pyridin-3-ylpropyl)piperidin-2-yl] benzenesulfonate Openeye Name: [2-methyl-1-[3-(3-pyridyl)propyl]-2-piperidyl] benzenesulfonate CAS Name: benzenesulfonic acid [2-methyl-1-[3-(3-pyridinyl)propyl]-2-piperidinyl] ester IUPAC Name: [2-methyl-1-(3-pyridin-3-ylpropyl)piperidin-2-yl] benzenesulfonate Traditional Name: benzenesulfonic acid [2-methyl-1-[3-(3-pyridyl)propyl]-2-piperidyl] ester Formula: C20H26N2O3S MolecularWeight: 374.49704

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCN1CCCC2=CN=CC=C2)OS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1(CCCCN1CCCC2=CN=CC=C2)OS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H26N2O3S/c1-20(25-26(23,24)19-11-3-2-4-12-19)13-5-6-15-22(20)16-8-10-18-9-7-14-21-17-18/h2-4,7,9,11-12,14,17H,5-6,8,10,13,15-16H2,1H3