2-[4-(3-methoxyphenyl)-3-methyl-5-oxidanylidene-1,2,4-triazol-1-yl]ethanenitrile

Systemtic Name: 2-[4-(3-methoxyphenyl)-3-methyl-5-oxidanylidene-1,2,4-triazol-1-yl]ethanenitrile Openeye Name: 2-[4-(3-methoxyphenyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]acetonitrile CAS Name: 2-[4-(3-methoxyphenyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]acetonitrile IUPAC Name: 2-[4-(3-methoxyphenyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]acetonitrile Traditional Name: 2-[5-keto-4-(3-methoxyphenyl)-3-methyl-1,2,4-triazol-1-yl]acetonitrile Formula: C12H12N4O2 MolecularWeight: 244.24928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)N1C2=CC(=CC=C2)OC)CC#N

Isomeric SMILES

CC1=NN(C(=O)N1C2=CC(=CC=C2)OC)CC#N

InChI

InChI=1S/C12H12N4O2/c1-9-14-15(7-6-13)12(17)16(9)10-4-3-5-11(8-10)18-2/h3-5,8H,7H2,1-2H3