tert-butyl 3-[[2-azanyl-5-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]phenyl]carbonylamino]propanoate

Systemtic Name: tert-butyl 3-[[2-azanyl-5-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]phenyl]carbonylamino]propanoate Openeye Name: tert-butyl 3-[[2-amino-5-[3-(tert-butoxycarbonylamino)propanoylamino]benzoyl]amino]propanoate CAS Name: 3-[[[2-amino-5-[[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]amino]phenyl]-oxomethyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[2-amino-5-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]benzoyl]amino]propanoate Traditional Name: 3-[[2-amino-5-[3-(tert-butoxycarbonylamino)propanoylamino]benzoyl]amino]propionic acid tert-butyl ester Formula: C22H34N4O6 MolecularWeight: 450.52856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H34N4O6/c1-21(2,3)31-18(28)10-12-24-19(29)15-13-14(7-8-16(15)23)26-17(27)9-11-25-20(30)32-22(4,5)6/h7-8,13H,9-12,23H2,1-6H3,(H,24,29)(H,25,30)(H,26,27)