2-(4-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile

Systemtic Name: 2-(4-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile Openeye Name: 2-(4-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile CAS Name: 2-(4-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile IUPAC Name: 2-(4-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)pentanenitrile Traditional Name: 2-(4-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)valeronitrile Formula: C15H18N4O MolecularWeight: 270.32962

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CN1C=NC=N1)(C#N)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCC(CN1C=NC=N1)(C#N)C2=CC=C(C=C2)OC

InChI

InChI=1S/C15H18N4O/c1-3-8-15(9-16,10-19-12-17-11-18-19)13-4-6-14(20-2)7-5-13/h4-7,11-12H,3,8,10H2,1-2H3