tert-butyl 4-(methoxymethyl)-4-phenylsulfanyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(methoxymethyl)-4-phenylsulfanyl-piperidine-1-carboxylate Openeye Name: tert-butyl 4-(methoxymethyl)-4-phenylsulfanyl-piperidine-1-carboxylate CAS Name: 4-(methoxymethyl)-4-(phenylthio)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(methoxymethyl)-4-phenylsulfanylpiperidine-1-carboxylate Traditional Name: 4-(methoxymethyl)-4-(phenylthio)piperidine-1-carboxylic acid tert-butyl ester Formula: C18H27NO3S MolecularWeight: 337.47688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)(COC)SC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)(COC)SC2=CC=CC=C2

InChI

InChI=1S/C18H27NO3S/c1-17(2,3)22-16(20)19-12-10-18(11-13-19,14-21-4)23-15-8-6-5-7-9-15/h5-9H,10-14H2,1-4H3