(3-tert-butyl-4-oxidanyl-cyclohexa-1,3-dien-1-yl)methyl piperidine-1-carbodithioate

Systemtic Name: (3-tert-butyl-4-oxidanyl-cyclohexa-1,3-dien-1-yl)methyl piperidine-1-carbodithioate Openeye Name: (3-tert-butyl-4-hydroxy-cyclohexa-1,3-dien-1-yl)methyl piperidine-1-carbodithioate CAS Name: 1-piperidinecarbodithioic acid (3-tert-butyl-4-hydroxy-1-cyclohexa-1,3-dienyl)methyl ester IUPAC Name: (3-tert-butyl-4-hydroxycyclohexa-1,3-dien-1-yl)methyl piperidine-1-carbodithioate Traditional Name: piperidine-1-carbodithioic acid (3-tert-butyl-4-hydroxy-cyclohexa-1,3-dien-1-yl)methyl ester Formula: C17H27NOS2 MolecularWeight: 325.53238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(CCC(=C1)CSC(=S)N2CCCCC2)O

Isomeric SMILES

CC(C)(C)C1=C(CCC(=C1)CSC(=S)N2CCCCC2)O

InChI

InChI=1S/C17H27NOS2/c1-17(2,3)14-11-13(7-8-15(14)19)12-21-16(20)18-9-5-4-6-10-18/h11,19H,4-10,12H2,1-3H3