2-[5-(5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1H-1,2,3,4-tetrazol-2-yl]ethanenitrile

Systemtic Name: 2-[5-(5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1H-1,2,3,4-tetrazol-2-yl]ethanenitrile Openeye Name: 2-[5-(5-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)-1H-tetrazol-2-yl]acetonitrile CAS Name: 2-[5-(5-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)-1H-tetrazol-2-yl]acetonitrile IUPAC Name: 2-[5-(5-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)-1H-tetrazol-2-yl]acetonitrile Traditional Name: 2-[5-(6-keto-5-methoxy-cyclohexa-2,4-dien-1-ylidene)-1H-tetrazol-2-yl]acetonitrile Formula: C10H9N5O2 MolecularWeight: 231.21076

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C2NN(N=N2)CC#N)C1=O

Isomeric SMILES

COC1=CC=CC(=C2NN(N=N2)CC#N)C1=O

InChI

InChI=1S/C10H9N5O2/c1-17-8-4-2-3-7(9(8)16)10-12-14-15(13-10)6-5-11/h2-4,13H,6H2,1H3