1-[3-(3,4-dimethylphenoxy)propyl]-1,2,4-triazole-3-carbonitrile

Systemtic Name: 1-[3-(3,4-dimethylphenoxy)propyl]-1,2,4-triazole-3-carbonitrile Openeye Name: 1-[3-(3,4-dimethylphenoxy)propyl]-1,2,4-triazole-3-carbonitrile CAS Name: 1-[3-(3,4-dimethylphenoxy)propyl]-1,2,4-triazole-3-carbonitrile IUPAC Name: 1-[3-(3,4-dimethylphenoxy)propyl]-1,2,4-triazole-3-carbonitrile Traditional Name: 1-[3-(3,4-dimethylphenoxy)propyl]-1,2,4-triazole-3-carbonitrile Formula: C14H16N4O MolecularWeight: 256.30304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCCCN2C=NC(=N2)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCCCN2C=NC(=N2)C#N)C

InChI

InChI=1S/C14H16N4O/c1-11-4-5-13(8-12(11)2)19-7-3-6-18-10-16-14(9-15)17-18/h4-5,8,10H,3,6-7H2,1-2H3