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

Systemtic Name: methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(3-prop-2-enylimidazol-4-yl)propanoate Openeye Name: methyl (2S)-3-(3-allylimidazol-4-yl)-2-(tert-butoxycarbonylamino)propanoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(3-prop-2-enyl-4-imidazolyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(3-prop-2-enylimidazol-4-yl)propanoate Traditional Name: (2S)-3-(3-allylimidazol-4-yl)-2-(tert-butoxycarbonylamino)propionic acid methyl ester Formula: C15H23N3O4 MolecularWeight: 309.36082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23N3O4/c1-6-7-18-10-16-9-11(18)8-12(13(19)21-5)17-14(20)22-15(2,3)4/h6,9-10,12H,1,7-8H2,2-5H3,(H,17,20)/t12-/m0/s1