tert-butyl (2S)-4-azanyl-2-[(1-azanylcyclohexyl)carbonylamino]-4-oxidanylidene-butanoate

Systemtic Name: tert-butyl (2S)-4-azanyl-2-[(1-azanylcyclohexyl)carbonylamino]-4-oxidanylidene-butanoate Openeye Name: tert-butyl (2S)-4-amino-2-[(1-aminocyclohexanecarbonyl)amino]-4-oxo-butanoate CAS Name: (2S)-4-amino-2-[[(1-aminocyclohexyl)-oxomethyl]amino]-4-oxobutanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-4-amino-2-[(1-aminocyclohexanecarbonyl)amino]-4-oxobutanoate Traditional Name: (2S)-4-amino-2-[(1-aminocyclohexanecarbonyl)amino]-4-keto-butyric acid tert-butyl ester Formula: C15H27N3O4 MolecularWeight: 313.39258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC(=O)N)NC(=O)C1(CCCCC1)N

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CC(=O)N)NC(=O)C1(CCCCC1)N

InChI

InChI=1S/C15H27N3O4/c1-14(2,3)22-12(20)10(9-11(16)19)18-13(21)15(17)7-5-4-6-8-15/h10H,4-9,17H2,1-3H3,(H2,16,19)(H,18,21)/t10-/m0/s1