tert-butyl carbamate; diethyl 2-[(4-ethylcyclohexyl)methyl]propanedioate

Systemtic Name: tert-butyl carbamate; diethyl 2-[(4-ethylcyclohexyl)methyl]propanedioate Openeye Name: tert-butyl carbamate; diethyl 2-[(4-ethylcyclohexyl)methyl]propanedioate CAS Name: carbamic acid tert-butyl ester; 2-[(4-ethylcyclohexyl)methyl]propanedioic acid diethyl ester IUPAC Name: tert-butyl carbamate; diethyl 2-[(4-ethylcyclohexyl)methyl]propanedioate Traditional Name: carbamic acid tert-butyl ester; 2-[(4-ethylcyclohexyl)methyl]malonic acid diethyl ester Formula: C21H39NO6 MolecularWeight: 401.53746

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(CC1)CC(C(=O)OCC)C(=O)OCC.CC(C)(C)OC(=O)N

Isomeric SMILES

CCC1CCC(CC1)CC(C(=O)OCC)C(=O)OCC.CC(C)(C)OC(=O)N

InChI

InChI=1S/C16H28O4.C5H11NO2/c1-4-12-7-9-13(10-8-12)11-14(15(17)19-5-2)16(18)20-6-3;1-5(2,3)8-4(6)7/h12-14H,4-11H2,1-3H3;1-3H3,(H2,6,7)