2-[4-[[3-(methoxymethyl)-5-propyl-1,2,4-triazol-4-yl]methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[[3-(methoxymethyl)-5-propyl-1,2,4-triazol-4-yl]methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[[3-(methoxymethyl)-5-propyl-1,2,4-triazol-4-yl]methyl]phenyl]benzonitrile CAS Name: 2-[4-[[3-(methoxymethyl)-5-propyl-1,2,4-triazol-4-yl]methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[[3-(methoxymethyl)-5-propyl-1,2,4-triazol-4-yl]methyl]phenyl]benzonitrile Traditional Name: 2-[4-[[3-(methoxymethyl)-5-propyl-1,2,4-triazol-4-yl]methyl]phenyl]benzonitrile Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)COC

Isomeric SMILES

CCCC1=NN=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)COC

InChI

InChI=1S/C21H22N4O/c1-3-6-20-23-24-21(15-26-2)25(20)14-16-9-11-17(12-10-16)19-8-5-4-7-18(19)13-22/h4-5,7-12H,3,6,14-15H2,1-2H3