tert-butyl 4-[2-[2-(hydroxymethyl)-1,3-dithian-2-yl]ethyl]-3-methylidene-piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[2-(hydroxymethyl)-1,3-dithian-2-yl]ethyl]-3-methylidene-piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-[2-(hydroxymethyl)-1,3-dithian-2-yl]ethyl]-3-methylene-piperidine-1-carboxylate CAS Name: 4-[2-[2-(hydroxymethyl)-1,3-dithian-2-yl]ethyl]-3-methylene-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[2-(hydroxymethyl)-1,3-dithian-2-yl]ethyl]-3-methylidenepiperidine-1-carboxylate Traditional Name: 3-methylene-4-[2-(2-methylol-1,3-dithian-2-yl)ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C18H31NO3S2 MolecularWeight: 373.57364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C(=C)C1)CCC2(SCCCS2)CO

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C(=C)C1)CCC2(SCCCS2)CO

InChI

InChI=1S/C18H31NO3S2/c1-14-12-19(16(21)22-17(2,3)4)9-7-15(14)6-8-18(13-20)23-10-5-11-24-18/h15,20H,1,5-13H2,2-4H3