tert-butyl 4-(1-but-2-ynyl-4-methanoyl-5-methoxycarbonyl-imidazol-2-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(1-but-2-ynyl-4-methanoyl-5-methoxycarbonyl-imidazol-2-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(1-but-2-ynyl-4-formyl-5-methoxycarbonyl-imidazol-2-yl)piperazine-1-carboxylate CAS Name: 4-(1-but-2-ynyl-4-formyl-5-methoxycarbonyl-2-imidazolyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1-but-2-ynyl-4-formyl-5-methoxycarbonylimidazol-2-yl)piperazine-1-carboxylate Traditional Name: 4-(1-but-2-ynyl-5-carbomethoxy-4-formyl-imidazol-2-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C19H26N4O5 MolecularWeight: 390.43354

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN1C(=C(N=C1N2CCN(CC2)C(=O)OC(C)(C)C)C=O)C(=O)OC

Isomeric SMILES

CC#CCN1C(=C(N=C1N2CCN(CC2)C(=O)OC(C)(C)C)C=O)C(=O)OC

InChI

InChI=1S/C19H26N4O5/c1-6-7-8-23-15(16(25)27-5)14(13-24)20-17(23)21-9-11-22(12-10-21)18(26)28-19(2,3)4/h13H,8-12H2,1-5H3