tert-butyl 3-azanyl-2-cyclohexyl-4-[4-(phenylmethoxycarbonylamino)butylamino]butanoate

Systemtic Name: tert-butyl 3-azanyl-2-cyclohexyl-4-[4-(phenylmethoxycarbonylamino)butylamino]butanoate Openeye Name: tert-butyl 3-amino-4-[4-(benzyloxycarbonylamino)butylamino]-2-cyclohexyl-butanoate CAS Name: 3-amino-2-cyclohexyl-4-[4-(phenylmethoxycarbonylamino)butylamino]butanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-amino-2-cyclohexyl-4-[4-(phenylmethoxycarbonylamino)butylamino]butanoate Traditional Name: 3-amino-4-[4-(benzyloxycarbonylamino)butylamino]-2-cyclohexyl-butyric acid tert-butyl ester Formula: C26H43N3O4 MolecularWeight: 461.63732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C1CCCCC1)C(CNCCCCNC(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

CC(C)(C)OC(=O)C(C1CCCCC1)C(CNCCCCNC(=O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C26H43N3O4/c1-26(2,3)33-24(30)23(21-14-8-5-9-15-21)22(27)18-28-16-10-11-17-29-25(31)32-19-20-12-6-4-7-13-20/h4,6-7,12-13,21-23,28H,5,8-11,14-19,27H2,1-3H3,(H,29,31)