methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(3-phenacylimidazol-4-yl)propanoate

Systemtic Name: methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(3-phenacylimidazol-4-yl)propanoate Openeye Name: methyl (2S)-2-(tert-butoxycarbonylamino)-3-(3-phenacylimidazol-4-yl)propanoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(3-phenacyl-4-imidazolyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(3-phenacylimidazol-4-yl)propanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-(3-phenacylimidazol-4-yl)propionic acid methyl ester Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CN=CN1CC(=O)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CN=CN1CC(=O)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C20H25N3O5/c1-20(2,3)28-19(26)22-16(18(25)27-4)10-15-11-21-13-23(15)12-17(24)14-8-6-5-7-9-14/h5-9,11,13,16H,10,12H2,1-4H3,(H,22,26)/t16-/m0/s1