ethyl 6-[5-(imidazol-1-ylmethyl)-2-oxidanylidene-1,3-dihydroimidazol-4-yl]-6-oxidanylidene-hexanoate

Systemtic Name: ethyl 6-[5-(imidazol-1-ylmethyl)-2-oxidanylidene-1,3-dihydroimidazol-4-yl]-6-oxidanylidene-hexanoate Openeye Name: ethyl 6-[5-(imidazol-1-ylmethyl)-2-oxo-1,3-dihydroimidazol-4-yl]-6-oxo-hexanoate CAS Name: 6-[5-(1-imidazolylmethyl)-2-oxo-1,3-dihydroimidazol-4-yl]-6-oxohexanoic acid ethyl ester IUPAC Name: ethyl 6-[5-(imidazol-1-ylmethyl)-2-oxo-1,3-dihydroimidazol-4-yl]-6-oxohexanoate Traditional Name: 6-[5-(imidazol-1-ylmethyl)-2-keto-4-imidazolin-4-yl]-6-keto-hexanoic acid ethyl ester Formula: C15H20N4O4 MolecularWeight: 320.3437

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCC(=O)C1=C(NC(=O)N1)CN2C=CN=C2

Isomeric SMILES

CCOC(=O)CCCCC(=O)C1=C(NC(=O)N1)CN2C=CN=C2

InChI

InChI=1S/C15H20N4O4/c1-2-23-13(21)6-4-3-5-12(20)14-11(17-15(22)18-14)9-19-8-7-16-10-19/h7-8,10H,2-6,9H2,1H3,(H2,17,18,22)