[2-(phenylmethylsulfanyl)cyclohexyl] 3-morpholin-4-ylpropanoate

Systemtic Name: [2-(phenylmethylsulfanyl)cyclohexyl] 3-morpholin-4-ylpropanoate Openeye Name: (2-benzylsulfanylcyclohexyl) 3-morpholinopropanoate CAS Name: 3-(4-morpholinyl)propanoic acid [2-(phenylmethylthio)cyclohexyl] ester IUPAC Name: (2-benzylsulfanylcyclohexyl) 3-morpholin-4-ylpropanoate Traditional Name: 3-morpholinopropionic acid [2-(benzylthio)cyclohexyl] ester Formula: C20H29NO3S MolecularWeight: 363.51416

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)OC(=O)CCN2CCOCC2)SCC3=CC=CC=C3

Isomeric SMILES

C1CCC(C(C1)OC(=O)CCN2CCOCC2)SCC3=CC=CC=C3

InChI

InChI=1S/C20H29NO3S/c22-20(10-11-21-12-14-23-15-13-21)24-18-8-4-5-9-19(18)25-16-17-6-2-1-3-7-17/h1-3,6-7,18-19H,4-5,8-16H2