4-[1-(phenylmethyl)piperidin-4-yl]butyl methanesulfonate

Systemtic Name: 4-[1-(phenylmethyl)piperidin-4-yl]butyl methanesulfonate Openeye Name: 4-(1-benzyl-4-piperidyl)butyl methanesulfonate CAS Name: methanesulfonic acid 4-[1-(phenylmethyl)-4-piperidinyl]butyl ester IUPAC Name: 4-(1-benzylpiperidin-4-yl)butyl methanesulfonate Traditional Name: methanesulfonic acid 4-(1-benzyl-4-piperidyl)butyl ester Formula: C17H27NO3S MolecularWeight: 325.46618

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCCCC1CCN(CC1)CC2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)OCCCCC1CCN(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C17H27NO3S/c1-22(19,20)21-14-6-5-7-16-10-12-18(13-11-16)15-17-8-3-2-4-9-17/h2-4,8-9,16H,5-7,10-15H2,1H3