tert-butyl N-[(2-methylpropan-2-yl)oxycarbonylamino]-N-(1-pyridin-3-ylcyclohexyl)carbamate

Systemtic Name: tert-butyl N-[(2-methylpropan-2-yl)oxycarbonylamino]-N-(1-pyridin-3-ylcyclohexyl)carbamate Openeye Name: tert-butyl N-(tert-butoxycarbonylamino)-N-[1-(3-pyridyl)cyclohexyl]carbamate CAS Name: N-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-N-[1-(3-pyridinyl)cyclohexyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2-methylpropan-2-yl)oxycarbonylamino]-N-(1-pyridin-3-ylcyclohexyl)carbamate Traditional Name: N-(tert-butoxycarbonylamino)-N-[1-(3-pyridyl)cyclohexyl]carbamic acid tert-butyl ester Formula: C21H33N3O4 MolecularWeight: 391.50442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN(C(=O)OC(C)(C)C)C1(CCCCC1)C2=CN=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NN(C(=O)OC(C)(C)C)C1(CCCCC1)C2=CN=CC=C2

InChI

InChI=1S/C21H33N3O4/c1-19(2,3)27-17(25)23-24(18(26)28-20(4,5)6)21(12-8-7-9-13-21)16-11-10-14-22-15-16/h10-11,14-15H,7-9,12-13H2,1-6H3,(H,23,25)