diethyl 2-(4-azidobutyl)-2-(3-imidazol-1-ylpropyl)propanedioate

Systemtic Name: diethyl 2-(4-azidobutyl)-2-(3-imidazol-1-ylpropyl)propanedioate Openeye Name: diethyl 2-(4-azidobutyl)-2-(3-imidazol-1-ylpropyl)propanedioate CAS Name: 2-(4-azidobutyl)-2-[3-(1-imidazolyl)propyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-(4-azidobutyl)-2-(3-imidazol-1-ylpropyl)propanedioate Traditional Name: 2-(4-azidobutyl)-2-(3-imidazol-1-ylpropyl)malonic acid diethyl ester Formula: C17H27N5O4 MolecularWeight: 365.42738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCN=[N+]=[N-])(CCCN1C=CN=C1)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CCCCN=[N+]=[N-])(CCCN1C=CN=C1)C(=O)OCC

InChI

InChI=1S/C17H27N5O4/c1-3-25-15(23)17(16(24)26-4-2,8-5-6-10-20-21-18)9-7-12-22-13-11-19-14-22/h11,13-14H,3-10,12H2,1-2H3