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

Systemtic Name: tert-butyl 3-azanyl-2-cyclohexyl-4-[2-phenylethanoyl-[4-(phenylmethoxycarbonylamino)butyl]amino]butanoate Openeye Name: tert-butyl 3-amino-4-[4-(benzyloxycarbonylamino)butyl-(2-phenylacetyl)amino]-2-cyclohexyl-butanoate CAS Name: 3-amino-2-cyclohexyl-4-[(1-oxo-2-phenylethyl)-[4-(phenylmethoxycarbonylamino)butyl]amino]butanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-amino-2-cyclohexyl-4-[(2-phenylacetyl)-[4-(phenylmethoxycarbonylamino)butyl]amino]butanoate Traditional Name: 3-amino-4-[4-(benzyloxycarbonylamino)butyl-(2-phenylacetyl)amino]-2-cyclohexyl-butyric acid tert-butyl ester Formula: C34H49N3O5 MolecularWeight: 579.76996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C1CCCCC1)C(CN(CCCCNC(=O)OCC2=CC=CC=C2)C(=O)CC3=CC=CC=C3)N

Isomeric SMILES

CC(C)(C)OC(=O)C(C1CCCCC1)C(CN(CCCCNC(=O)OCC2=CC=CC=C2)C(=O)CC3=CC=CC=C3)N

InChI

InChI=1S/C34H49N3O5/c1-34(2,3)42-32(39)31(28-19-11-6-12-20-28)29(35)24-37(30(38)23-26-15-7-4-8-16-26)22-14-13-21-36-33(40)41-25-27-17-9-5-10-18-27/h4-5,7-10,15-18,28-29,31H,6,11-14,19-25,35H2,1-3H3,(H,36,40)