ethyl (1E)-N-[4-cyano-2-(4-phenylbutyl)pyrazol-3-yl]methanimidate

Systemtic Name: ethyl (1E)-N-[4-cyano-2-(4-phenylbutyl)pyrazol-3-yl]methanimidate Openeye Name: ethyl (1E)-N-[4-cyano-2-(4-phenylbutyl)pyrazol-3-yl]methanimidate CAS Name: (1E)-N-[4-cyano-2-(4-phenylbutyl)-3-pyrazolyl]methanimidic acid ethyl ester IUPAC Name: ethyl (1E)-N-[4-cyano-2-(4-phenylbutyl)pyrazol-3-yl]methanimidate Traditional Name: (1E)-N-[4-cyano-2-(4-phenylbutyl)pyrazol-3-yl]formimidic acid ethyl ester Formula: C17H20N4O MolecularWeight: 296.3669

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC=NC1=C(C=NN1CCCCC2=CC=CC=C2)C#N

Isomeric SMILES

CCO/C=N/C1=C(C=NN1CCCCC2=CC=CC=C2)C#N

InChI

InChI=1S/C17H20N4O/c1-2-22-14-19-17-16(12-18)13-20-21(17)11-7-6-10-15-8-4-3-5-9-15/h3-5,8-9,13-14H,2,6-7,10-11H2,1H3/b19-14+