tert-butyl N-[6-[[(2S)-2-azanyl-3-phenyl-propanoyl]-cyclohexyl-amino]hexyl]carbamate

Systemtic Name: tert-butyl N-[6-[[(2S)-2-azanyl-3-phenyl-propanoyl]-cyclohexyl-amino]hexyl]carbamate Openeye Name: tert-butyl N-[6-[[(2S)-2-amino-3-phenyl-propanoyl]-cyclohexyl-amino]hexyl]carbamate CAS Name: N-[6-[[(2S)-2-amino-1-oxo-3-phenylpropyl]-cyclohexylamino]hexyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[6-[[(2S)-2-amino-3-phenylpropanoyl]-cyclohexylamino]hexyl]carbamate Traditional Name: N-[6-[[(2S)-2-amino-3-phenyl-propanoyl]-cyclohexyl-amino]hexyl]carbamic acid tert-butyl ester Formula: C26H43N3O3 MolecularWeight: 445.63792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCCCN(C1CCCCC1)C(=O)C(CC2=CC=CC=C2)N

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCCCN(C1CCCCC1)C(=O)[C@H](CC2=CC=CC=C2)N

InChI

InChI=1S/C26H43N3O3/c1-26(2,3)32-25(31)28-18-12-4-5-13-19-29(22-16-10-7-11-17-22)24(30)23(27)20-21-14-8-6-9-15-21/h6,8-9,14-15,22-23H,4-5,7,10-13,16-20,27H2,1-3H3,(H,28,31)/t23-/m0/s1