ditert-butyl (2S)-2-[(3-methylimidazol-3-ium-1-yl)carbonylamino]pentanedioate

Systemtic Name: ditert-butyl (2S)-2-[(3-methylimidazol-3-ium-1-yl)carbonylamino]pentanedioate Openeye Name: ditert-butyl (2S)-2-[(3-methylimidazol-3-ium-1-carbonyl)amino]pentanedioate CAS Name: (2S)-2-[[(3-methyl-1-imidazol-3-iumyl)-oxomethyl]amino]pentanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl (2S)-2-[(3-methylimidazol-3-ium-1-carbonyl)amino]pentanedioate Traditional Name: (2S)-2-[(3-methylimidazol-3-ium-1-carbonyl)amino]glutaric acid ditert-butyl ester Formula: C18H30N3O5+ MolecularWeight: 368.4479

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC(C(=O)OC(C)(C)C)NC(=O)N1C=C[N+](=C1)C

Isomeric SMILES

CC(C)(C)OC(=O)CC[C@@H](C(=O)OC(C)(C)C)NC(=O)N1C=C[N+](=C1)C

InChI

InChI=1S/C18H29N3O5/c1-17(2,3)25-14(22)9-8-13(15(23)26-18(4,5)6)19-16(24)21-11-10-20(7)12-21/h10-13H,8-9H2,1-7H3/p+1/t13-/m0/s1