1-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-1,2,4-triazole-3-carbonitrile

Systemtic Name: 1-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-1,2,4-triazole-3-carbonitrile Openeye Name: 1-[[3-(4-methoxyphenyl)isoxazol-5-yl]methyl]-1,2,4-triazole-3-carbonitrile CAS Name: 1-[[3-(4-methoxyphenyl)-5-isoxazolyl]methyl]-1,2,4-triazole-3-carbonitrile IUPAC Name: 1-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-1,2,4-triazole-3-carbonitrile Traditional Name: 1-[[3-(4-methoxyphenyl)isoxazol-5-yl]methyl]-1,2,4-triazole-3-carbonitrile Formula: C14H11N5O2 MolecularWeight: 281.26944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=C2)CN3C=NC(=N3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=C2)CN3C=NC(=N3)C#N

InChI

InChI=1S/C14H11N5O2/c1-20-11-4-2-10(3-5-11)13-6-12(21-18-13)8-19-9-16-14(7-15)17-19/h2-6,9H,8H2,1H3