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

Systemtic Name: (1E)-N-[5-cyano-3-(phenylmethyl)imidazol-4-yl]nonanimidate Openeye Name: (1E)-N-(3-benzyl-5-cyano-imidazol-4-yl)nonanimidate CAS Name: (1E)-N-[5-cyano-3-(phenylmethyl)-4-imidazolyl]nonanimidate IUPAC Name: (1E)-N-(3-benzyl-5-cyanoimidazol-4-yl)nonanimidate Traditional Name: (1E)-N-(3-benzyl-5-cyano-imidazol-4-yl)pelargonimidate Formula: C20H25N4O- MolecularWeight: 337.4387

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O/c1-2-3-4-5-6-10-13-19(25)23-20-18(14-21)22-16-24(20)15-17-11-8-7-9-12-17/h7-9,11-12,16H,2-6,10,13,15H2,1H3,(H,23,25)/p-1