2,3-dimethyl-4-(1,2,3,4-tetrazol-2-ylmethyl)-1-benzofuran-7-carbonitrile

Systemtic Name: 2,3-dimethyl-4-(1,2,3,4-tetrazol-2-ylmethyl)-1-benzofuran-7-carbonitrile Openeye Name: 2,3-dimethyl-4-(tetrazol-2-ylmethyl)benzofuran-7-carbonitrile CAS Name: 2,3-dimethyl-4-(2-tetrazolylmethyl)-7-benzofurancarbonitrile IUPAC Name: 2,3-dimethyl-4-(tetrazol-2-ylmethyl)-1-benzofuran-7-carbonitrile Traditional Name: 2,3-dimethyl-4-(tetrazol-2-ylmethyl)benzofuran-7-carbonitrile Formula: C13H11N5O MolecularWeight: 253.25934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C=CC(=C12)CN3N=CN=N3)C#N)C

Isomeric SMILES

CC1=C(OC2=C(C=CC(=C12)CN3N=CN=N3)C#N)C

InChI

InChI=1S/C13H11N5O/c1-8-9(2)19-13-10(5-14)3-4-11(12(8)13)6-18-16-7-15-17-18/h3-4,7H,6H2,1-2H3