methyl (2S)-6-[2-(1H-imidazol-5-yl)ethylamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate

Systemtic Name: methyl (2S)-6-[2-(1H-imidazol-5-yl)ethylamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate Openeye Name: methyl (2S)-2-(tert-butoxycarbonylamino)-6-[2-(1H-imidazol-5-yl)ethylamino]hexanoate CAS Name: (2S)-6-[2-(1H-imidazol-5-yl)ethylamino]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl (2S)-6-[2-(1H-imidazol-5-yl)ethylamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-6-[2-(1H-imidazol-5-yl)ethylamino]hexanoic acid methyl ester Formula: C17H30N4O4 MolecularWeight: 354.4445

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCCNCCC1=CN=CN1)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCCCNCCC1=CN=CN1)C(=O)OC

InChI

InChI=1S/C17H30N4O4/c1-17(2,3)25-16(23)21-14(15(22)24-4)7-5-6-9-18-10-8-13-11-19-12-20-13/h11-12,14,18H,5-10H2,1-4H3,(H,19,20)(H,21,23)/t14-/m0/s1