(1E)-N-[5-cyano-3-(phenylmethyl)imidazol-4-yl]hexanimidate

Systemtic Name: (1E)-N-[5-cyano-3-(phenylmethyl)imidazol-4-yl]hexanimidate Openeye Name: (1E)-N-(3-benzyl-5-cyano-imidazol-4-yl)hexanimidate CAS Name: (1E)-N-[5-cyano-3-(phenylmethyl)-4-imidazolyl]hexanimidate IUPAC Name: (1E)-N-(3-benzyl-5-cyanoimidazol-4-yl)hexanimidate Traditional Name: (1E)-N-(3-benzyl-5-cyano-imidazol-4-yl)hexanimidate Formula: C17H19N4O- MolecularWeight: 295.35896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=NC1=C(N=CN1CC2=CC=CC=C2)C#N)[O-]

Isomeric SMILES

CCCCC/C(=N\C1=C(N=CN1CC2=CC=CC=C2)C#N)/[O-]

InChI

InChI=1S/C17H20N4O/c1-2-3-5-10-16(22)20-17-15(11-18)19-13-21(17)12-14-8-6-4-7-9-14/h4,6-9,13H,2-3,5,10,12H2,1H3,(H,20,22)/p-1