diethyl 2-[[(2R,3S)-3-hexyl-1-[(2-methylpropan-2-yl)oxycarbonyl]aziridin-2-yl]carbonylamino]propanedioate

Systemtic Name: diethyl 2-[[(2R,3S)-3-hexyl-1-[(2-methylpropan-2-yl)oxycarbonyl]aziridin-2-yl]carbonylamino]propanedioate Openeye Name: diethyl 2-[[(2R,3S)-1-tert-butoxycarbonyl-3-hexyl-aziridine-2-carbonyl]amino]propanedioate CAS Name: 2-[[[(2R,3S)-3-hexyl-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-aziridinyl]-oxomethyl]amino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(2R,3S)-3-hexyl-1-[(2-methylpropan-2-yl)oxycarbonyl]aziridine-2-carbonyl]amino]propanedioate Traditional Name: 2-[[(2R,3S)-1-tert-butoxycarbonyl-3-hexyl-ethylenimine-2-carbonyl]amino]malonic acid diethyl ester Formula: C21H36N2O7 MolecularWeight: 428.51974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(N1C(=O)OC(C)(C)C)C(=O)NC(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCCCCC[C@H]1[C@@H](N1C(=O)OC(C)(C)C)C(=O)NC(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C21H36N2O7/c1-7-10-11-12-13-14-16(23(14)20(27)30-21(4,5)6)17(24)22-15(18(25)28-8-2)19(26)29-9-3/h14-16H,7-13H2,1-6H3,(H,22,24)/t14-,16+,23?/m0/s1