[1-(phenylcarbonyl)piperidin-4-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [1-(phenylcarbonyl)piperidin-4-yl]methyl 4-methylbenzenesulfonate Openeye Name: (1-benzoyl-4-piperidyl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (1-benzoyl-4-piperidinyl)methyl ester IUPAC Name: (1-benzoylpiperidin-4-yl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-benzoyl-4-piperidyl)methyl ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCN(CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCN(CC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H23NO4S/c1-16-7-9-19(10-8-16)26(23,24)25-15-17-11-13-21(14-12-17)20(22)18-5-3-2-4-6-18/h2-10,17H,11-15H2,1H3