tert-butyl N-[(2R)-1-[1,3-benzodioxol-5-ylmethyl(2-cyclohexylethanoyl)amino]propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2R)-1-[1,3-benzodioxol-5-ylmethyl(2-cyclohexylethanoyl)amino]propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1R)-2-[1,3-benzodioxol-5-ylmethyl-(2-cyclohexylacetyl)amino]-1-methyl-ethyl]carbamate CAS Name: N-[(2R)-1-[1,3-benzodioxol-5-ylmethyl-(2-cyclohexyl-1-oxoethyl)amino]propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-1-[1,3-benzodioxol-5-ylmethyl-(2-cyclohexylacetyl)amino]propan-2-yl]carbamate Traditional Name: N-[(1R)-2-[(2-cyclohexylacetyl)-piperonyl-amino]-1-methyl-ethyl]carbamic acid tert-butyl ester Formula: C24H36N2O5 MolecularWeight: 432.55304

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CC1=CC2=C(C=C1)OCO2)C(=O)CC3CCCCC3)NC(=O)OC(C)(C)C

Isomeric SMILES

C[C@H](CN(CC1=CC2=C(C=C1)OCO2)C(=O)CC3CCCCC3)NC(=O)OC(C)(C)C

InChI

InChI=1S/C24H36N2O5/c1-17(25-23(28)31-24(2,3)4)14-26(22(27)13-18-8-6-5-7-9-18)15-19-10-11-20-21(12-19)30-16-29-20/h10-12,17-18H,5-9,13-16H2,1-4H3,(H,25,28)/t17-/m1/s1