[2-cyano-3-(1-prop-2-enylpiperidin-4-yl)phenyl] methanesulfonate

Systemtic Name: [2-cyano-3-(1-prop-2-enylpiperidin-4-yl)phenyl] methanesulfonate Openeye Name: [3-(1-allyl-4-piperidyl)-2-cyano-phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-cyano-3-(1-prop-2-enyl-4-piperidinyl)phenyl] ester IUPAC Name: [2-cyano-3-(1-prop-2-enylpiperidin-4-yl)phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-(1-allyl-4-piperidyl)-2-cyano-phenyl] ester Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC=CC(=C1C#N)C2CCN(CC2)CC=C

Isomeric SMILES

CS(=O)(=O)OC1=CC=CC(=C1C#N)C2CCN(CC2)CC=C

InChI

InChI=1S/C16H20N2O3S/c1-3-9-18-10-7-13(8-11-18)14-5-4-6-16(15(14)12-17)21-22(2,19)20/h3-6,13H,1,7-11H2,2H3