2-(3-methylimidazol-3-ium-1-yl)ethyl (2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate

Systemtic Name: 2-(3-methylimidazol-3-ium-1-yl)ethyl (2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Openeye Name: 2-(3-methylimidazol-3-ium-1-yl)ethyl (2S)-2-(tert-butoxycarbonylamino)-4-methyl-pentanoate CAS Name: (2S)-4-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid 2-(3-methyl-1-imidazol-3-iumyl)ethyl ester IUPAC Name: 2-(3-methylimidazol-3-ium-1-yl)ethyl (2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-4-methyl-valeric acid 2-(3-methylimidazol-3-ium-1-yl)ethyl ester Formula: C17H30N3O4+ MolecularWeight: 340.4378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCCN1C=C[N+](=C1)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)OCCN1C=C[N+](=C1)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H29N3O4/c1-13(2)11-14(18-16(22)24-17(3,4)5)15(21)23-10-9-20-8-7-19(6)12-20/h7-8,12-14H,9-11H2,1-6H3/p+1/t14-/m0/s1