methyl 3-(1-methylimidazol-4-yl)-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]propanoate

Systemtic Name: methyl 3-(1-methylimidazol-4-yl)-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]propanoate Openeye Name: methyl 2-[2-(tert-butoxycarbonylamino)ethylamino]-3-(1-methylimidazol-4-yl)propanoate CAS Name: 3-(1-methyl-4-imidazolyl)-2-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethylamino]propanoic acid methyl ester IUPAC Name: methyl 3-(1-methylimidazol-4-yl)-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]propanoate Traditional Name: 2-[2-(tert-butoxycarbonylamino)ethylamino]-3-(1-methylimidazol-4-yl)propionic acid methyl ester Formula: C15H26N4O4 MolecularWeight: 326.39134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCNC(CC1=CN(C=N1)C)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NCCNC(CC1=CN(C=N1)C)C(=O)OC

InChI

InChI=1S/C15H26N4O4/c1-15(2,3)23-14(21)17-7-6-16-12(13(20)22-5)8-11-9-19(4)10-18-11/h9-10,12,16H,6-8H2,1-5H3,(H,17,21)