tert-butyl N-octyl-N-[(E)-1-[(1S,2R)-2-oxidanylcyclohexyl]prop-1-enyl]carbamate

Systemtic Name: tert-butyl N-octyl-N-[(E)-1-[(1S,2R)-2-oxidanylcyclohexyl]prop-1-enyl]carbamate Openeye Name: tert-butyl N-[(E)-1-[(1S,2R)-2-hydroxycyclohexyl]prop-1-enyl]-N-octyl-carbamate CAS Name: N-[(E)-1-[(1S,2R)-2-hydroxycyclohexyl]prop-1-enyl]-N-octylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E)-1-[(1S,2R)-2-hydroxycyclohexyl]prop-1-enyl]-N-octylcarbamate Traditional Name: N-[(E)-1-[(1S,2R)-2-hydroxycyclohexyl]prop-1-enyl]-N-octyl-carbamic acid tert-butyl ester Formula: C22H41NO3 MolecularWeight: 367.56584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(C(=CC)C1CCCCC1O)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCN(/C(=C/C)/[C@@H]1CCCC[C@H]1O)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H41NO3/c1-6-8-9-10-11-14-17-23(21(25)26-22(3,4)5)19(7-2)18-15-12-13-16-20(18)24/h7,18,20,24H,6,8-17H2,1-5H3/b19-7+/t18-,20+/m0/s1