tert-butyl N-[3-[[(2S)-1-(tert-butylamino)-3-cyclohexyl-1-oxidanylidene-propan-2-yl]amino]-2-oxidanyl-propyl]carbamate

Systemtic Name: tert-butyl N-[3-[[(2S)-1-(tert-butylamino)-3-cyclohexyl-1-oxidanylidene-propan-2-yl]amino]-2-oxidanyl-propyl]carbamate Openeye Name: tert-butyl N-[3-[[(1S)-2-(tert-butylamino)-1-(cyclohexylmethyl)-2-oxo-ethyl]amino]-2-hydroxy-propyl]carbamate CAS Name: N-[3-[[(2S)-1-(tert-butylamino)-3-cyclohexyl-1-oxopropan-2-yl]amino]-2-hydroxypropyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[[(2S)-1-(tert-butylamino)-3-cyclohexyl-1-oxopropan-2-yl]amino]-2-hydroxypropyl]carbamate Traditional Name: N-[3-[[(1S)-2-(tert-butylamino)-1-(cyclohexylmethyl)-2-keto-ethyl]amino]-2-hydroxy-propyl]carbamic acid tert-butyl ester Formula: C21H41N3O4 MolecularWeight: 399.56794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(CC1CCCCC1)NCC(CNC(=O)OC(C)(C)C)O

Isomeric SMILES

CC(C)(C)NC(=O)[C@H](CC1CCCCC1)NCC(CNC(=O)OC(C)(C)C)O

InChI

InChI=1S/C21H41N3O4/c1-20(2,3)24-18(26)17(12-15-10-8-7-9-11-15)22-13-16(25)14-23-19(27)28-21(4,5)6/h15-17,22,25H,7-14H2,1-6H3,(H,23,27)(H,24,26)/t16?,17-/m0/s1