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

Systemtic Name: (1E)-N-[5-cyano-3-(phenylmethyl)imidazol-4-yl]heptanimidate Openeye Name: (1E)-N-(3-benzyl-5-cyano-imidazol-4-yl)heptanimidate CAS Name: (1E)-N-[5-cyano-3-(phenylmethyl)-4-imidazolyl]heptanimidate IUPAC Name: (1E)-N-(3-benzyl-5-cyanoimidazol-4-yl)heptanimidate Traditional Name: (1E)-N-(3-benzyl-5-cyano-imidazol-4-yl)enanthimidate Formula: C18H21N4O- MolecularWeight: 309.38554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4O/c1-2-3-4-8-11-17(23)21-18-16(12-19)20-14-22(18)13-15-9-6-5-7-10-15/h5-7,9-10,14H,2-4,8,11,13H2,1H3,(H,21,23)/p-1